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1026679-06-0 | 2-Quinazolinamine, 4-chloro-8-methyl-
CAS No: 1026679-06-0 Catalog No: AG00081S MDL No:
Product Description
Catalog Number:
AG00081S
Chemical Name:
2-Quinazolinamine, 4-chloro-8-methyl-
CAS Number:
1026679-06-0
Molecular Formula:
C9H8ClN3
Molecular Weight:
193.6329
IUPAC Name:
4-chloro-8-methylquinazolin-2-amine
InChI:
InChI=1S/C9H8ClN3/c1-5-3-2-4-6-7(5)12-9(11)13-8(6)10/h2-4H,1H3,(H2,11,12,13)
InChI Key:
HKLAFWMXOPWEJY-UHFFFAOYSA-N
SMILES:
Nc1nc(Cl)c2c(n1)c(C)ccc2
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.041g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.634g/mol
Monoisotopic Mass:
193.041g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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