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4-Hydroxy-4'-aminobiphenyl

CAT: 0926-FH67343-01Size: 2 gDry Ice: NoHazardous: No
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CAT#:0926-FH67343-01Size:2 g
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CAS Number
1204-79-1
MDL Number
MFCD00463439
Smiles
C1=CC (=CC=C1C2=CC=C (C=C2) O) N
Molecular Formula
C12H11NO
Molecular Weight
185.22 g/mol
Controlled
No

Chemical Information

4-Amino-4'-hydroxybiphenyl

4'-aminobiphenyl-4-ol is an aminobiphenyl whose amino group is at C-4 and is hydroxylated at C-4'. It is functionally related to a biphenyl-4-amine.

CAS Number1204-79-1
PubChem CID14565
IUPAC Name4-(4-aminophenyl)phenol
Molecular FormulaC12H11NO
Molecular Weight185.22
XLogP1.7
Topological Polar Surface Area46.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count14
Formal Charge0
Complexity167
SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)O)N
InChI
InChI=1S/C12H11NO/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8,14H,13H2
InChIKey
LQZZZAFQKXTFKH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Amino-4'-hydroxybiphenyl
CAS: 1204-79-1
CID: 14565
Formula: C12H11NO
MW: 185.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight185.22
XLogP31.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass185.084063974
Monoisotopic Mass185.084063974
Topological Polar Surface Area46.3 Ų
Heavy Atom Count14
Formal Charge0
Complexity167
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes