4-Bromocumene

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H11Br
Molecular Weight	199.088
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-Bromocumene

Structure Search

SMILES

CC(C)C1=CC=C(Br)C=C1

InChI

InChIKey=MOZHUOIQYVYEPN-UHFFFAOYSA-N

InChI=1S/C9H11Br/c1-7(2)8-3-5-9(10)6-4-8/h3-7H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C9H11Br
Molecular Weight	199.088
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 17:44:42 GMT 2025` Edited by `admin` on `Tue Apr 01 17:44:42 GMT 2025`
Record UNII	3SYA3DG4GJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-Bromocumene

Systematic Name

English

NSC-97223

Preferred Name

English

Cumene, p-bromo-

Systematic Name

English

1-Bromo-4-(1-methylethyl)benzene

Systematic Name

English

p-Bromocumene

Systematic Name

English

Benzene, 1-bromo-4-(1-methylethyl)-

Systematic Name

English

Code System Code Type Description

NSC

97223

Created by admin on Tue Apr 01 17:44:42 GMT 2025 , Edited by admin on Tue Apr 01 17:44:42 GMT 2025

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ECHA (EC/EINECS)

209-577-5

Created by admin on Tue Apr 01 17:44:42 GMT 2025 , Edited by admin on Tue Apr 01 17:44:42 GMT 2025

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EPA CompTox

DTXSID7060411

Created by admin on Tue Apr 01 17:44:42 GMT 2025 , Edited by admin on Tue Apr 01 17:44:42 GMT 2025

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FDA UNII

3SYA3DG4GJ

Created by admin on Tue Apr 01 17:44:42 GMT 2025 , Edited by admin on Tue Apr 01 17:44:42 GMT 2025

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PUBCHEM

11462

Created by admin on Tue Apr 01 17:44:42 GMT 2025 , Edited by admin on Tue Apr 01 17:44:42 GMT 2025

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CAS

586-61-8

Created by admin on Tue Apr 01 17:44:42 GMT 2025 , Edited by admin on Tue Apr 01 17:44:42 GMT 2025

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