Home Other Building Blocks 7-hydroxy-3,4-dihydro-2H-1,3-benzoxazin-2-one

7-hydroxy-3,4-dihydro-2H-1,3-benzoxazin-2-one

CAS No.:
1783742-44-8
Catalog Number:
AG01DTCU
Molecular Formula:
C8H7NO3
Molecular Weight:
165.1461
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Product Description
Catalog Number:
AG01DTCU
Chemical Name:
7-hydroxy-3,4-dihydro-2H-1,3-benzoxazin-2-one
CAS Number:
1783742-44-8
Molecular Formula:
C8H7NO3
Molecular Weight:
165.1461
MDL Number:
MFCD28552407
IUPAC Name:
7-hydroxy-3,4-dihydro-1,3-benzoxazin-2-one
InChI:
InChI=1S/C8H7NO3/c10-6-2-1-5-4-9-8(11)12-7(5)3-6/h1-3,10H,4H2,(H,9,11)
InChI Key:
ACLPXHIBSCDLOU-UHFFFAOYSA-N
SMILES:
Oc1cc2OC(=O)NCc2cc1
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.043g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.148g/mol
Monoisotopic Mass:
165.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties