Home Halogens 6-amino-7-chloro-2H,3H,4H-pyrido[3,2-b][1,4]oxazin-3-one

6-amino-7-chloro-2H,3H,4H-pyrido[3,2-b][1,4]oxazin-3-one

CAS No.:
337463-98-6
Catalog Number:
AG01AUCA
Molecular Formula:
C7H6ClN3O2
Molecular Weight:
199.5944
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Product Description
Catalog Number:
AG01AUCA
Chemical Name:
6-amino-7-chloro-2H,3H,4H-pyrido[3,2-b][1,4]oxazin-3-one
CAS Number:
337463-98-6
Molecular Formula:
C7H6ClN3O2
Molecular Weight:
199.5944
MDL Number:
MFCD30180315
IUPAC Name:
6-amino-7-chloro-4H-pyrido[3,2-b][1,4]oxazin-3-one
InChI:
InChI=1S/C7H6ClN3O2/c8-3-1-4-7(11-6(3)9)10-5(12)2-13-4/h1H,2H2,(H3,9,10,11,12)
InChI Key:
RMJOKOITQIZNIP-UHFFFAOYSA-N
SMILES:
O=C1COc2c(N1)nc(c(c2)Cl)N
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
199.594g/mol
Monoisotopic Mass:
199.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties