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90903-98-3 | Carbamic acid, (methylsulfonyl)-, phenylmethyl ester
CAS No: 90903-98-3 Catalog No: AG006GOQ MDL No:
Product Description
Catalog Number:
AG006GOQ
Chemical Name:
Carbamic acid, (methylsulfonyl)-, phenylmethyl ester
CAS Number:
90903-98-3
Molecular Formula:
C9H11NO4S
Molecular Weight:
229.2529
IUPAC Name:
benzyl N-methylsulfonylcarbamate
InChI:
InChI=1S/C9H11NO4S/c1-15(12,13)10-9(11)14-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,10,11)
InChI Key:
REWRGJSWLNPCNT-UHFFFAOYSA-N
SMILES:
O=C(NS(=O)(=O)C)OCc1ccccc1
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.041g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.25g/mol
Monoisotopic Mass:
229.041g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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