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2050-89-7 | [1,1'-Biphenyl]-3,3'-diamine
CAS No: 2050-89-7 Catalog No: AG0029TX MDL No:MFCD00210852
Product Description
Catalog Number:
AG0029TX
Chemical Name:
[1,1'-Biphenyl]-3,3'-diamine
CAS Number:
2050-89-7
Molecular Formula:
C12H12N2
Molecular Weight:
184.2371
MDL Number:
MFCD00210852
IUPAC Name:
3-(3-aminophenyl)aniline
InChI:
InChI=1S/C12H12N2/c13-11-5-1-3-9(7-11)10-4-2-6-12(14)8-10/h1-8H,13-14H2
InChI Key:
NDXGRHCEHPFUSU-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)c1cccc(c1)N
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
184.242g/mol
Monoisotopic Mass:
184.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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