2-(4-NEOPENTYLPHENOXY)ANILINE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H21NO
Molecular Weight	255.3547
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(4-NEOPENTYLPHENOXY)ANILINE

Structure Search

SMILES

CC(C)(C)CC1=CC=C(OC2=CC=CC=C2N)C=C1

InChI

InChIKey=OJQBKBWOUORGAL-UHFFFAOYSA-N

InChI=1S/C17H21NO/c1-17(2,3)12-13-8-10-14(11-9-13)19-16-7-5-4-6-15(16)18/h4-11H,12,18H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C17H21NO
Molecular Weight	255.3547
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 12:30:12 GMT 2023` Edited by `admin` on `Sat Dec 16 12:30:12 GMT 2023`
Record UNII	LR1312SDI6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-(4-NEOPENTYLPHENOXY)ANILINE

Systematic Name

English

2-(4-(2,2-DIMETHYLPROPYL)PHENOXY)BENZENAMINE

Systematic Name

English

BENZENAMINE, 2-(4-(2,2-DIMETHYLPROPYL)PHENOXY)-

Systematic Name

English

Code System Code Type Description

FDA UNII

LR1312SDI6

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

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EPA CompTox

DTXSID60241492

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

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CAS

94442-02-1

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

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ECHA (EC/EINECS)

305-328-0

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

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PUBCHEM

3024359

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

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