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19808-35-6 | 4-Quinazolinamine, 6-chloro-
CAS No: 19808-35-6 Catalog No: AG002BAD MDL No:MFCD02676502
Product Description
Catalog Number:
AG002BAD
Chemical Name:
4-Quinazolinamine, 6-chloro-
CAS Number:
19808-35-6
Molecular Formula:
C8H6ClN3
Molecular Weight:
179.6063
MDL Number:
MFCD02676502
IUPAC Name:
6-chloroquinazolin-4-amine
InChI:
InChI=1S/C8H6ClN3/c9-5-1-2-7-6(3-5)8(10)12-4-11-7/h1-4H,(H2,10,11,12)
InChI Key:
KMYOLSIBCDCWQQ-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)c(N)ncn2
NSC Number:
266861
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.607g/mol
Monoisotopic Mass:
179.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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