6-Methyl-5-hepten-2-ol

HCID 20745CAS 1569-60-4
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)=CCCC(C)O
InChIKey
OHEFFKYYKJVVOX-UHFFFAOYSA-N
Molecular formula
C8H16O
Average molar mass
128.21 g/mol
Monoisotopic mass
128.12011513

Overview

Sulcatol is a secondary alcohol. It has a role as a pheromone.

Names & identifiers

Preferred name
6-Methyl-5-hepten-2-ol
IUPAC
6-methylhept-5-en-2-ol
English name
(R)-(-)-6-Methyl-5-hepten-2-ol
Molecular formula
C8H16O
Molecular weight
128.21

Names & synonyms

6-METHYL-5-HEPTEN-2-OL6-Methylhept-5-en-2-ol1569-60-4Sulcatol5-Hepten-2-ol, 6-methyl-6-Hydroxy-2-methyl-2-hepteneDTXSID8051754NSC-6627333321H09GIDTXCID7030309FEMA NO. 4884CHEBI:15833
Show more names
6-methyl-5-hepten-2-oIsometheptene Impurity 4(R)-6-METHYL-5-HEPTEN-2-OL(n)-6-methyl-5-hepten-2-ol(±)-6-Methyl-5-hepten-2-ol6-METHYL-5-HEPTEN-2-OL 99+%
RefChem:889486216-377-1(+/-)-6-Methyl-5-Hepten-2-ol4630-06-22-Methyl-2-hepten-6-olMFCD00004561NSC 662736-methyl-hept-5-en-2-ol

Database identifiers

CAS
1569-60-4、4630-06-2
PubChem CID
20745
DTXSID
DTXSID8051754
ChEBI
CHEBI:15833
UNII
33321H09GI
EC Number
216-377-1
Nikkaji
J44.141D

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
9

Experimental & physicochemical properties

LipidsFatty Acyls [FA] -> Fatty alcohols [FA05]
FragrancesFragrance Ingredient (2-Methyl-2-hepten-6-ol) -> IFRA transparency List
Food AdditivesFLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Flavoring AgentsEU Flavoring substances

Physicochemical properties

Melting point
-31.5 °C · -31.5°C (estimate)
Boiling point
78 °C/14 · 78 °C/14 mmHg (lit.)
Density
0.844 g/mL · 0.844 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.448(lit.)
FLAVIS Number
2.124 · 02.124 | 6-Methylhept-5-en-2-ol
Flash point
154 °F · 154 °F

Safety & regulation

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 98.6% (142 of 144) of all reports.

Not Classified

Aggregated GHS information provided per 144 reports by companies from 2 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 3 items

Chemical: 5-Hepten-2-ol, 6-methyl-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

5-Hepten-2-ol, 6-methyl-: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - 5-Hepten-2-ol, 6-methyl-: Environment tier I assessment
Hazard Classes and CategoriesNot Classified

Safety data

wgk
3
tsca
TSCA listed
risk_code
40-67-36/37/38
Signal word
Warning
Symbol(GHS)
GHS08
hazard_code
Xn

Chemistry & industry

Pharmacology

Cellular LocationsCytoplasm

Uses & manufacturing

Use ClassificationFragrance Ingredients
General Manufacturing Information5-Hepten-2-ol, 6-methyl-: ACTIVE

Applications

UsesSulcatol is an compound used in the synthesis of aggregation pheromone of the ambrosia beetle, an insect pest of harvested timber in the Pacific North Coast.

Suppliers46 total

南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]

Additional notes

DefinitionChEBI: Sulcatol is a secondary alcohol. It has a role as a pheromone.

Related reactions

4 records
New reaction record

Linked notes

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