nopyl aldehyde

fragrance agents

2D:
3D:
CAS Number:	30897-75-7
ECHA EC Number:	250-376-7
FDA UNII:	Search
Category:	fragrance agents
IUPAC Name:	nopyl aldehyde
InChI :	InChI=1/C11H16O/c1-11(2)9-4-3-8(5-6-12)10(11)7-9/h3,6,9-10H,4-5,7H2,1-2H3
Std.InChI:	InChI=1S/C11H16O/c1-11(2)9-4-3-8(5-6-12)10(11)7-9/h3,6,9-10H,4-5,7H2,1-2H3
InChIKey :	BLKPFVWYBFDTPX-UHFFFAOYAU
Std.InChIKey:	BLKPFVWYBFDTPX-UHFFFAOYSA-N
SMILES :	CC1(C2CC=C(C1C2)CC=O)C
Molar Refractivity :	48.76 ± 0.3 cm3 (est)
Parachor :	396.5 ± 6.0 cm3 (est)
Index of Refraction :	1.486 ± 0.02 (est)
Surface Tension :	29.7 ± 3.0 dyne/cm (est)
Density :	0.967 ± 0.06 g/cm3 (est)
Polarizability :	19.33 ± 0.5 10-24cm3 (est)

US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:

Google Scholar:	Search
Google Books:	Search
Google Scholar: with word "volatile"	Search
Google Scholar: with word "flavor"	Search
Google Scholar: with word "odor"	Search
Perfumer and Flavorist:	Search
Google Patents:	Search
US Patents:	Search
EU Patents:	Search
Pubchem Patents:	Search
PubMed:	Search
NCBI:	Search

Physical Properties:

Appearance:	colorless clear liquid (est)
Assay:	95.00 to 100.00
Food Chemicals Codex Listed:	No
Specific Gravity:	1.00400 to 1.01000 @ 25.00 °C.
Pounds per Gallon - (est).:	8.354 to 8.404
Boiling Point:	210.00 to 211.00 °C. @ 760.00 mm Hg
Vapor Pressure:	0.178000 mmHg @ 25.00 °C. (est)
Flash Point:	171.00 °F. TCC ( 77.22 °C. )
logP (o/w):	2.871 (est)
Soluble in:
	alcohol
	water, 105.4 mg/L @ 25 °C (est)
Insoluble in:
	alcohol

Organoleptic Properties:

woody pine oily fatty

Cosmetic Information:

None found

Suppliers:

BOC Sciences

For experimental / research use only.

6,6-dimethylbicyclo[3.1.1]hept-2-en-2-acetaldehyde

Safety Information:


Hazards identification

Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements

Pictogram

Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in Use Information:

Category:
fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for nopyl aldehyde usage levels up to:
	1.0000 % in the fragrance concentrate.

Recommendation for nopyl aldehyde flavor usage levels up to:
	not for flavor use.

Safety References:

EPI System: View

AIDS Citations:Search

Cancer Citations:Search

Toxicology Citations:Search

EPA Substance Registry Services (TSCA):30897-75-7

EPA ACToR:Toxicology Data

EPA Substance Registry Services (SRS):Registry

Laboratory Chemical Safety Summary :169211

National Institute of Allergy and Infectious Diseases:Data

WGK Germany:2

2-(7,7-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)acetaldehyde

Chemidplus:0030897757

References:

	2-(7,7-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)acetaldehyde
NIST Chemistry WebBook:	Search Inchi
Pubchem (cid):	169211
Pubchem (sid):	135124741

Other Information:

(IUPAC):	Atomic Weights of the Elements 2011 (pdf)
Videos:	The Periodic Table of Videos
tgsc:	Atomic Weights use for this web site
(IUPAC):	Periodic Table of the Elements
HMDB (The Human Metabolome Database):	Search
Export Tariff Code:	2915.13.0000
ChemSpider:	View

Potential Blenders and core components :

For Odor

balsamic

abies alba cone oil
FR

abies alba needle oil
FL/FR

laevo-

borneol
FL/FR

dextro,laevo-

borneol
FL/FR

laevo-

bornyl acetate
FL/FR

iso

bornyl methyl ether
FL/FR

dextro-

fenchone
FL/FR

fir balsam absolute
FR

gurjun balsam
FR

camphoreous

beta-homo

cyclocitral
FL/FR

fenchol
FL/FR

laevo-

fenchone
FL/FR

cheesy

methyl hexanoic acid
FL/FR

coffee

furfuryl mercaptan
FL/FR

creamy

gamma-

butyrolactone
FL/FR

earthy

scotch

pine needle oil
FL/FR

scotch

pine needle oil estonia
FL/FR

scotch

pine needle oil yugoslavia
FL/FR

fatty

butter esters
FL/FR

(Z)-

ethyl oleate
FL/FR

perilla seed oil
FL/FR

(E,Z,Z)-2,4,7-

tridecatrienal
FL/FR

floral

octanal / methyl anthranilate schiff's base
FR

orris rhizome absolute (iris pallida)
FL/FR

pentadecanone
FL/FR

verdyl acetate
FR

fruity

butyl 2-decenoate
FL/FR

iso

butyl furyl propionate
FL/FR

dodecyl isobutyrate
FL/FR

(R)-(-)-2-

heptanol
FL/FR

green

ethyl (E)-4-decenoate
FL/FR

iso

green methanoindene
FR

(Z)-4-

hepten-1-ol
FL/FR

(Z)-3-

hepten-1-ol
FL/FR

(Z)-4-

heptenal
FL/FR

neryl butyrate
FL/FR

herbal

herbal specialty
FR

hydroxydihydrotheaspirane (mixture of isomers)
FL/FR

myrtenol
FL/FR

nopyl acetate
FR

alpha-

pinene
FL/FR

laevo-beta-

pinene
FL/FR

pinocarveol
FL/FR

terpineols (unspec.) (mixed isomers)
FL/FR

terpinolene
FL/FR

mushroom

(S)-(+)-2-

heptanol
FL/FR

oily

amyl laurate
FL/FR

butter acids
FL/FR

pine

evergreen fragrance
FR

white

pine bark oil
FL/FR

spicy

ayou wood oil
FR

ortho-

methoxycinnamaldehyde
FL/FR

outdoors specialty
FR

terpenic

cypress leaf oil
FR

D-(+)-beta-

pinene
FL/FR

gamma-

terpinene
FL/FR

waxy

iso

amyl laurate
FL/FR

delta-

tetradecalactone
FL/FR

woody

iso

bornyl isovalerate
FL/FR

cedarwood oil port orford
FR

cedarwood oil virginia
FR

(E+Z)-4,8-

dimethyl-3,7-nonadien-2-ol
FL/FR

para-

menth-3-en-1-ol
FL/FR

myoporum crassifolium wood oil
FR

myrtenyl formate
FL/FR

cis-2-

pinanol
FR

For Flavor

No flavor group found for these

amyl laurate
FL/FR

dextro,laevo-

borneol
FL/FR

iso

bornyl methyl ether
FL/FR

(E+Z)-4,8-

dimethyl-3,7-nonadien-2-ol
FL/FR

dodecyl isobutyrate
FL/FR

(R)-(-)-2-

heptanol
FL/FR

(S)-(+)-2-

heptanol
FL/FR

(Z)-3-

hepten-1-ol
FL/FR

para-

menth-3-en-1-ol
FL/FR

myrtenyl formate
FL/FR

perilla seed oil
FL/FR

white

pine bark oil
FL/FR

scotch

pine needle oil
FL/FR

scotch

pine needle oil estonia
FL/FR

scotch

pine needle oil yugoslavia
FL/FR

D-(+)-beta-

pinene
FL/FR

laevo-beta-

pinene
FL/FR

terpineols (unspec.) (mixed isomers)
FL/FR

iso

butyl furyl propionate
FL/FR

balsamic

laevo-

bornyl acetate
FL/FR

bitter

(E,Z,Z)-2,4,7-

tridecatrienal
FL/FR

camphoreous

laevo-

borneol
FL/FR

bornyl acetate
FL/FR

fenchol
FL/FR

laevo-

fenchone
FL/FR

hydroxydihydrotheaspirane (mixture of isomers)
FL/FR

pinocarveol
FL/FR

coffee

furfuryl mercaptan
FL/FR

cooling

beta-homo

cyclocitral
FL/FR

dextro-

fenchone
FL/FR

creamy

butter esters
FL/FR

fatty

iso

amyl laurate
FL/FR

butter acids
FL/FR

ethyl (E)-4-decenoate
FL/FR

(Z)-

ethyl oleate
FL/FR

pentadecanone
FL/FR

fruity

butyl 2-decenoate
FL/FR

green

(Z)-4-

hepten-1-ol
FL/FR

(Z)-4-

heptenal
FL/FR

neryl butyrate
FL/FR

milky

gamma-

butyrolactone
FL/FR

minty

myrtenol
FL/FR

oily

methyl hexanoic acid
FL/FR

spicy

ortho-

methoxycinnamaldehyde
FL/FR

sweet

orris rhizome absolute (iris pallida)
FL/FR

terpenic

abies alba needle oil
FL/FR

gamma-

terpinene
FL/FR

waxy

delta-

tetradecalactone
FL/FR

woody

iso

bornyl isovalerate
FL/FR

alpha-

pinene
FL/FR

terpinolene
FL/FR

Potential Uses:

FR	bergamot
	enhancer
FR	galbanum
FR	rosemary

Occurrence (nature, food, other):

not found in nature

Synonyms:

	bicyclo(3.1.1)hept-2-ene-2-acetaldehyde, 6,6-dimethyl-
	bicyclo[3.1.1]hept-2-ene-2-acetaldehyde, 6,6-dimethyl-
6,6-	dimethyl bicyclo(3.1.1)hept-2-en-2-acetaldehyde
2-(7,7-	dimethyl-4-bicyclo(3.1.1)hept-3-enyl) acetaldehyde
2-(7,7-	dimethyl-4-bicyclo[3.1.1]hept-3-enyl)acetaldehyde
6,6-	dimethylbicyclo(3.1.1)hept-2-en-2-acetaldehyde
6,6-	dimethylbicyclo[3.1.1]hept-2-en-2-acetaldehyde
(6,6-	dimethylbicyclo[3.1.1]hept-2-en-2-yl)acetaldehyde
	nopylaldehyde

Articles:

None found yet. Try the PubMed Search.

CONTENTS

EU/US Properties Organoleptic EU/US Suppliers Safety Safety in use Safety reference References Other Blenders Uses Occurrence Synonyms Articles