2-Hydroxy-2-propylvaleronitrile

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H15NO
Molecular Weight	141.2108
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-Hydroxy-2-propylvaleronitrile

Structure Search

SMILES

CCCC(O)(CCC)C#N

InChI

InChIKey=YYZBOCPIORDHRR-UHFFFAOYSA-N

InChI=1S/C8H15NO/c1-3-5-8(10,7-9)6-4-2/h10H,3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C8H15NO
Molecular Weight	141.2108
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 11:51:45 GMT 2023` Edited by `admin` on `Sat Dec 16 11:51:45 GMT 2023`
Record UNII	5CJC7M8J2Y
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-Hydroxy-2-propylvaleronitrile

Systematic Name

English

Pentanenitrile, 2-hydroxy-2-propyl-

Systematic Name

English

2-Hydroxy-2-propylpentanenitrile

Systematic Name

English

2-Hydroxy-2-propyl-valeronitrile

Systematic Name

English

Valeronitrile, 2-hydroxy-2-propyl-

Systematic Name

English

Code System Code Type Description

CAS

5699-74-1

Created by admin on Sat Dec 16 11:51:45 GMT 2023 , Edited by admin on Sat Dec 16 11:51:45 GMT 2023

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EPA CompTox

DTXSID00205598

Created by admin on Sat Dec 16 11:51:45 GMT 2023 , Edited by admin on Sat Dec 16 11:51:45 GMT 2023

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PUBCHEM

79777

Created by admin on Sat Dec 16 11:51:45 GMT 2023 , Edited by admin on Sat Dec 16 11:51:45 GMT 2023

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ECHA (EC/EINECS)

227-183-1

Created by admin on Sat Dec 16 11:51:45 GMT 2023 , Edited by admin on Sat Dec 16 11:51:45 GMT 2023

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FDA UNII

5CJC7M8J2Y

Created by admin on Sat Dec 16 11:51:45 GMT 2023 , Edited by admin on Sat Dec 16 11:51:45 GMT 2023

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