3-HEPTEN-2-ONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H12O
Molecular Weight	112.1696
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC\C=C\C(C)=O

InChI

InChIKey=JHHZQADGLDKIPM-AATRIKPKSA-N

InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h5-6H,3-4H2,1-2H3/b6-5+

HIDE SMILES / InChI

Molecular Formula	C7H12O
Molecular Weight	112.1696
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:04:07 GMT 2023` Edited by `admin` on `Fri Dec 15 17:04:07 GMT 2023`
Record UNII	TK02T5FJDO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-HEPTEN-2-ONE

Systematic Name

English

FEMA NO. 3400

Code

English

3-HEPTEN-2-ONE, (E)-

Systematic Name

English

3-HEPTEN-2-ONE [FHFI]

Common Name

English

(E)-3-HEPTEN-2-ONE

Systematic Name

English

(3E)-HEPT-3-EN-2-ONE

Systematic Name

English

3-HEPTEN-2-ONE, (3E)-

Systematic Name

English

TRANS-3-HEPTEN-2-ONE

Systematic Name

English

BUTYLIDENEACETONE

Systematic Name

English

METHYL PENTENYL KETONE

Systematic Name

English

Classification Tree Code System Code

JECFA EVALUATION

3-HEPTEN-2-ONE