3-METHYL-2-BUTENOYL CHLORIDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H7ClO
Molecular Weight	118.561
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-METHYL-2-BUTENOYL CHLORIDE

Structure Search

SMILES

CC(C)=CC(Cl)=O

InChI

InChIKey=BDUBTLFQHNYXPC-UHFFFAOYSA-N

InChI=1S/C5H7ClO/c1-4(2)3-5(6)7/h3H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C5H7ClO
Molecular Weight	118.561
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:11:54 GMT 2023` Edited by `admin` on `Sat Dec 16 19:11:54 GMT 2023`
Record UNII	F5J5J5448C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-METHYL-2-BUTENOYL CHLORIDE

Systematic Name

English

2-BUTENOYL CHLORIDE, 3-METHYL-

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

222-109-4

Created by admin on Sat Dec 16 19:11:54 GMT 2023 , Edited by admin on Sat Dec 16 19:11:54 GMT 2023

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EPA CompTox

DTXSID80187146

Created by admin on Sat Dec 16 19:11:54 GMT 2023 , Edited by admin on Sat Dec 16 19:11:54 GMT 2023

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PUBCHEM

102394

Created by admin on Sat Dec 16 19:11:54 GMT 2023 , Edited by admin on Sat Dec 16 19:11:54 GMT 2023

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FDA UNII

F5J5J5448C

Created by admin on Sat Dec 16 19:11:54 GMT 2023 , Edited by admin on Sat Dec 16 19:11:54 GMT 2023

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CAS

3350-78-5

Created by admin on Sat Dec 16 19:11:54 GMT 2023 , Edited by admin on Sat Dec 16 19:11:54 GMT 2023

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