Home Halogens Methyl 4-chloroquinazoline-8-carboxylate

Methyl 4-chloroquinazoline-8-carboxylate

CAS No.:
903130-01-8
Catalog Number:
AG00GRU7
Molecular Formula:
C10H7ClN2O2
Molecular Weight:
222.6278
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Product Description
Catalog Number:
AG00GRU7
Chemical Name:
Methyl 4-chloroquinazoline-8-carboxylate
CAS Number:
903130-01-8
Molecular Formula:
C10H7ClN2O2
Molecular Weight:
222.6278
MDL Number:
MFCD08448164
IUPAC Name:
methyl 4-chloroquinazoline-8-carboxylate
InChI:
InChI=1S/C10H7ClN2O2/c1-15-10(14)7-4-2-3-6-8(7)12-5-13-9(6)11/h2-5H,1H3
InChI Key:
CAZALFALOKHBET-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc2c1ncnc2Cl
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.02g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.628g/mol
Monoisotopic Mass:
222.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties