4-HYDROXY-2-(2-HYDROXYETHYL)-2-PHENYLBUTYRONITRILE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H15NO2
Molecular Weight	205.253
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-HYDROXY-2-(2-HYDROXYETHYL)-2-PHENYLBUTYRONITRILE

Structure Search

SMILES

OCCC(CCO)(C#N)C1=CC=CC=C1

InChI

InChIKey=UOZFONUAKNTHHC-UHFFFAOYSA-N

InChI=1S/C12H15NO2/c13-10-12(6-8-14,7-9-15)11-4-2-1-3-5-11/h1-5,14-15H,6-9H2

HIDE SMILES / InChI

Molecular Formula	C12H15NO2
Molecular Weight	205.253
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 12:02:57 GMT 2023` Edited by `admin` on `Sat Dec 16 12:02:57 GMT 2023`
Record UNII	4UDK632LSJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-HYDROXY-2-(2-HYDROXYETHYL)-2-PHENYLBUTYRONITRILE

Systematic Name

English

.ALPHA.,.ALPHA.-BIS(2-HYDROXYETHYL)BENZENEACETONITRILE

Systematic Name

English

NSC-211412

Code

English

BENZENEACETONITRILE, .ALPHA.,.ALPHA.-BIS(2-HYDROXYETHYL)-

Common Name

English

Code System Code Type Description

ECHA (EC/EINECS)

233-958-5

Created by admin on Sat Dec 16 12:02:57 GMT 2023 , Edited by admin on Sat Dec 16 12:02:57 GMT 2023

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FDA UNII

4UDK632LSJ

Created by admin on Sat Dec 16 12:02:57 GMT 2023 , Edited by admin on Sat Dec 16 12:02:57 GMT 2023

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CAS

10469-27-9

Created by admin on Sat Dec 16 12:02:57 GMT 2023 , Edited by admin on Sat Dec 16 12:02:57 GMT 2023

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EPA CompTox

DTXSID60146650

Created by admin on Sat Dec 16 12:02:57 GMT 2023 , Edited by admin on Sat Dec 16 12:02:57 GMT 2023

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NSC

211412

Created by admin on Sat Dec 16 12:02:57 GMT 2023 , Edited by admin on Sat Dec 16 12:02:57 GMT 2023

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PUBCHEM

82647

Created by admin on Sat Dec 16 12:02:57 GMT 2023 , Edited by admin on Sat Dec 16 12:02:57 GMT 2023

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