4-Aminobiphenyl

CAT: 0572-TRC-A601781-10GSize: 10 gDry Ice: NoHazardous: No

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CAT#:0572-TRC-A601781-10GSize:10 g

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CAS Number

92-67-1

Synonyms

4-Biphenylamine (8CI); (1,1'-Biphenyl-4-yl)amine; 4-Amino-1,1'-biphenyl; 4-Aminodiphenyl; 4-Biphenylylamine; 4-Phenylaniline; 4-Phenylbenzenamine; NSC 7660; Xenylamine; p-Aminobiphenyl; p-Aminodiphenyl; p-Aminophenyl benzene; p-Biphenylamine; p-Phenylaniline; p-Xenylamine

Hazard Statement

Harmful if swallowed

Purity

>95% (HPLC)

Smiles

Nc1ccc(cc1)c2ccccc2

Molecular Formula

C12 H11 N

Molecular Weight

169.22

InChI

InChI=1S/C12H11N/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,13H2

Additionnal Information

IUPAC name: 4-phenylaniline

Shipping Conditions

Room Temperature

Storage Conditions

-20°C

Chemical Information

4-Aminobiphenyl

4-Aminobiphenyl (4-aminodiphenyl) can cause cancer according to California Labor Code.

CAS Number	92-67-1
PubChem CID	7102
IUPAC Name	4-phenylaniline
Molecular Formula	C12H11N
Molecular Weight	169.22
XLogP	2.9
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	141

SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)N

InChI

InChI=1S/C12H11N/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,13H2

InChIKey

DMVOXQPQNTYEKQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 92-67-1

CID: 7102

Formula: C12H11N

MW: 169.22

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	169.22
XLogP3	2.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	169.089149355
Monoisotopic Mass	169.089149355
Topological Polar Surface Area	26 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	141
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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AR-B01698-01	4-Aminobiphenyl-d9
FH67343-01	4-Hydroxy-4'-aminobiphenyl
FC02179-01	4-Cyano-4'-aminobiphenyl
OR963407-01	4'-Aminobiphenyl-4-carbonitrile
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4-Aminobiphenyl

Chemical Information

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