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

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NCATS

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 of 5-HEPTEN-2-ONE, (E)-

Structure Search

SMILES

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

InChI

InChIKey=RTYRONIMTRDBLT-ONEGZZNKSA-N

InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h3-4H,5-6H2,1-2H3/b4-3+

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

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:30:02 GMT 2023` Edited by `admin` on `Sat Dec 16 12:30:02 GMT 2023`
Record UNII	YGD1BH6T9S
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

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

Systematic Name

English

NSC-128161

Code

English

TRANS-5-HEPTEN-2-ONE

Systematic Name

English

(5E)-5-HEPTEN-2-ONE

Systematic Name

English

2-HEPTEN-6-ONE

Systematic Name

English

5-HEPTEN-2-ONE

Systematic Name

English

(E)-5-HEPTEN-2-ONE

Systematic Name

English

Code System Code Type Description

FDA UNII

YGD1BH6T9S

Created by admin on Sat Dec 16 12:30:02 GMT 2023 , Edited by admin on Sat Dec 16 12:30:02 GMT 2023

PRIMARY

PUBCHEM

5363108

Created by admin on Sat Dec 16 12:30:02 GMT 2023 , Edited by admin on Sat Dec 16 12:30:02 GMT 2023

PRIMARY

NSC

128161

Created by admin on Sat Dec 16 12:30:02 GMT 2023 , Edited by admin on Sat Dec 16 12:30:02 GMT 2023

PRIMARY

ECHA (EC/EINECS)

229-768-7

Created by admin on Sat Dec 16 12:30:02 GMT 2023 , Edited by admin on Sat Dec 16 12:30:02 GMT 2023

PRIMARY

CAS

920490-04-6

Created by admin on Sat Dec 16 12:30:02 GMT 2023 , Edited by admin on Sat Dec 16 12:30:02 GMT 2023

ALTERNATIVE

CAS

1071-94-9

Created by admin on Sat Dec 16 12:30:02 GMT 2023 , Edited by admin on Sat Dec 16 12:30:02 GMT 2023

PRIMARY

CAS

6714-00-7

Created by admin on Sat Dec 16 12:30:02 GMT 2023 , Edited by admin on Sat Dec 16 12:30:02 GMT 2023

NON-SPECIFIC STEREOCHEMISTRY