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1393179-35-5 | 5-Pyrimidinecarbonitrile, 2-amino-4-chloro-
CAS No: 1393179-35-5 Catalog No: AG001APW MDL No:MFCD27923125
Product Description
Catalog Number:
AG001APW
Chemical Name:
5-Pyrimidinecarbonitrile, 2-amino-4-chloro-
CAS Number:
1393179-35-5
Molecular Formula:
C5H3ClN4
Molecular Weight:
154.5571
MDL Number:
MFCD27923125
IUPAC Name:
2-amino-4-chloropyrimidine-5-carbonitrile
InChI:
InChI=1S/C5H3ClN4/c6-4-3(1-7)2-9-5(8)10-4/h2H,(H2,8,9,10)
InChI Key:
UPUMETVQYQSNGW-UHFFFAOYSA-N
SMILES:
N#Cc1cnc(nc1Cl)N
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.005g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.557g/mol
Monoisotopic Mass:
154.005g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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