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1261900-78-0 | [1,1'-Biphenyl]-3-carbonitrile, 3'-amino-5-hydroxy-
CAS No: 1261900-78-0 Catalog No: AG000S4I MDL No:MFCD18314150
Product Description
Catalog Number:
AG000S4I
Chemical Name:
[1,1'-Biphenyl]-3-carbonitrile, 3'-amino-5-hydroxy-
CAS Number:
1261900-78-0
Molecular Formula:
C13H10N2O
Molecular Weight:
210.2313
MDL Number:
MFCD18314150
IUPAC Name:
3-(3-aminophenyl)-5-hydroxybenzonitrile
InChI:
InChI=1S/C13H10N2O/c14-8-9-4-11(7-13(16)5-9)10-2-1-3-12(15)6-10/h1-7,16H,15H2
InChI Key:
OVYAQDYNWUBATQ-UHFFFAOYSA-N
SMILES:
N#Cc1cc(O)cc(c1)c1cccc(c1)N
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.079g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.236g/mol
Monoisotopic Mass:
210.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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