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1260811-66-2 | 1H-Pyrido[3,4-b][1,4]oxazin-2(3H)-one, 5-chloro-
CAS No: 1260811-66-2 Catalog No: AG000RCP MDL No:MFCD15526859
Product Description
Catalog Number:
AG000RCP
Chemical Name:
1H-Pyrido[3,4-b][1,4]oxazin-2(3H)-one, 5-chloro-
CAS Number:
1260811-66-2
Molecular Formula:
C7H5ClN2O2
Molecular Weight:
184.5798
MDL Number:
MFCD15526859
IUPAC Name:
5-chloro-1H-pyrido[3,4-b][1,4]oxazin-2-one
InChI:
InChI=1S/C7H5ClN2O2/c8-7-6-4(1-2-9-7)10-5(11)3-12-6/h1-2H,3H2,(H,10,11)
InChI Key:
FHNIOFLISORNMS-UHFFFAOYSA-N
SMILES:
Clc1nccc2c1OCC(=O)N2
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.004g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.579g/mol
Monoisotopic Mass:
184.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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