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1267216-41-0

1267216-41-0 | 2(3H)-Benzoxazolone, 3,7-dimethyl-

CAS No: 1267216-41-0 Catalog No: AG000T4R MDL No:MFCD19374514

Product Description

Catalog Number:
AG000T4R
Chemical Name:
2(3H)-Benzoxazolone, 3,7-dimethyl-
CAS Number:
1267216-41-0
Molecular Formula:
C9H9NO2
Molecular Weight:
163.1733
MDL Number:
MFCD19374514
IUPAC Name:
3,7-dimethyl-1,3-benzoxazol-2-one
InChI:
InChI=1S/C9H9NO2/c1-6-4-3-5-7-8(6)12-9(11)10(7)2/h3-5H,1-2H3
InChI Key:
JEGIAJUIQOJZPN-UHFFFAOYSA-N
SMILES:
Cc1cccc2c1oc(=O)n2C

Properties

Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.063g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.176g/mol
Monoisotopic Mass:
163.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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