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2-Methyl-6-methylideneocta-1,7-dien-3-one

HCID 93231
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
41702-60-7
Standard SMILES
C=CC(=C)CCC(=O)C(=C)C
InChIKey
YZWOKWMEQQCMRN-UHFFFAOYSA-N
Molecular formula
C10H14O
Average molar mass
150.22 g/mol
Monoisotopic mass
150.10446507

Overview

2-Methyl-6-methylideneocta-1,7-dien-3-one has been reported in Curcuma mangga, Rhododendron tomentosum, and other organisms with data available.

Names & identifiers

Preferred name
2-Methyl-6-methylideneocta-1,7-dien-3-one
IUPAC
2-methyl-6-methylideneocta-1,7-dien-3-one
English name
2-Methyl-6-methylene-1,7-octadien-3-one
Molecular formula
C10H14O
Molecular weight
150.22

Names & synonyms

41702-60-72-methyl-6-methylideneocta-1,7-dien-3-one2-Methyl-6-methylidene-1,7-octadien-3-oneDTXSID90961914RefChem:475808DTXCID701389729828-466-82-Methyl-6-methylene-1,7-octadien-3-one2-methyl-6-methyleneocta-1,7-dien-3-one1,7-Octadien-3-one, 2-methyl-6-methylene-starbld0030106SCHEMBL31483827
Show more names
2,6-Dimethyleneoct-7-en-3-oneYZWOKWMEQQCMRN-UHFFFAOYSA-NRBA702602-Methyl-6-methylen-octa-1,7-dien-3-one2-Methyl-6-methylene-1,7-octadien-3-one #EN300-6489236

Database identifiers

CAS
41702-60-7
PubChem CID
93231
DTXSID
DTXSID90961914
EC Number
828-466-8
Nikkaji
J130.955B

Properties

Computed structural properties

XLogP
3
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
5
Heavy atoms
11
Formal charge
0
Complexity
199

Physicochemical properties

Boiling point
219.3 · 219.3±19.0 °C(Predicted)
Density
0.855 · 0.855±0.06 g/cm3(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H302-H332-H335-H319-H227
Precautionary statements
261 · P261-P271-P304+P340-P312-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P210-P280-P370+P378-P403+P235-P501-P264-P270-P301+P312-P330-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H227 (100%): Combustible liquid [Warning Flammable liquids]

P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 4 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H302-H332-H335-H319-H227
Precautionary statements
P261-P271-P304+P340-P312-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P210-P280-P370+P378-P403+P235-P501-P264-P270-P301+P312-P330-P501

Chemistry & industry

Suppliers1 total

宝欧信特生物科技(苏州)有限公司51288865780 · [email protected]

Related reactions

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Compound notes

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