3-Chloro-2,2-dimethyl-1-propanol

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H11ClO
Molecular Weight	122.593
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-Chloro-2,2-dimethyl-1-propanol

Structure Search

SMILES

CC(C)(CO)CCl

InChI

InChIKey=CAZPRAORHCOIHC-UHFFFAOYSA-N

InChI=1S/C5H11ClO/c1-5(2,3-6)4-7/h7H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C5H11ClO
Molecular Weight	122.593
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 `Tue Apr 01 17:40:34 GMT 2025` Edited by `admin` on `Tue Apr 01 17:40:34 GMT 2025`
Record UNII	5FQ825URV5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-Propanol, 3-chloro-2,2-dimethyl-

Preferred Name

English

3-Chloro-2,2-dimethyl-1-propanol

Systematic Name

English

3-Chloro-2,2-dimethylpropan-1-ol

Systematic Name

English

3-Chloro-2,2-dimethylpropanol

Common Name

English

NSC-245179

Code

English

Code System Code Type Description

FDA UNII

5FQ825URV5

Created by admin on Tue Apr 01 17:40:34 GMT 2025 , Edited by admin on Tue Apr 01 17:40:34 GMT 2025

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PUBCHEM

83407

Created by admin on Tue Apr 01 17:40:34 GMT 2025 , Edited by admin on Tue Apr 01 17:40:34 GMT 2025

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EPA CompTox

DTXSID5065433

Created by admin on Tue Apr 01 17:40:34 GMT 2025 , Edited by admin on Tue Apr 01 17:40:34 GMT 2025

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NSC

245179

Created by admin on Tue Apr 01 17:40:34 GMT 2025 , Edited by admin on Tue Apr 01 17:40:34 GMT 2025

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CAS

13401-56-4

Created by admin on Tue Apr 01 17:40:34 GMT 2025 , Edited by admin on Tue Apr 01 17:40:34 GMT 2025

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ECHA (EC/EINECS)

236-488-9

Created by admin on Tue Apr 01 17:40:34 GMT 2025 , Edited by admin on Tue Apr 01 17:40:34 GMT 2025

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