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88429-01-0 | Carbamic acid, [4-[(diethylamino)sulfonyl]phenyl]-, phenyl ester
CAS No: 88429-01-0 Catalog No: AG004ESD MDL No:
Product Description
Catalog Number:
AG004ESD
Chemical Name:
Carbamic acid, [4-[(diethylamino)sulfonyl]phenyl]-, phenyl ester
CAS Number:
88429-01-0
Molecular Formula:
C17H20N2O4S
Molecular Weight:
348.4167
IUPAC Name:
phenyl N-[4-(diethylsulfamoyl)phenyl]carbamate
InChI:
InChI=1S/C17H20N2O4S/c1-3-19(4-2)24(21,22)16-12-10-14(11-13-16)18-17(20)23-15-8-6-5-7-9-15/h5-13H,3-4H2,1-2H3,(H,18,20)
InChI Key:
XFAFKKCPVVBAJN-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1ccc(cc1)NC(=O)Oc1ccccc1)CC
Properties
Complexity:
485
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.114g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
348.417g/mol
Monoisotopic Mass:
348.114g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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