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Home > Nitro Compounds > 65750-59-6
65750-59-6 | (4-nitrophenyl)methyl (2-mercaptoethyl)carbamate
CAS No: 65750-59-6 Catalog No: AG00FHNR MDL No:
Product Description
Catalog Number:
AG00FHNR
Chemical Name:
(4-nitrophenyl)methyl (2-mercaptoethyl)carbamate
CAS Number:
65750-59-6
IUPAC Name:
(4-nitrophenyl)methyl N-(2-sulfanylethyl)carbamate
InChI:
InChI=1S/C10H12N2O4S/c13-10(11-5-6-17)16-7-8-1-3-9(4-2-8)12(14)15/h1-4,17H,5-7H2,(H,11,13)
InChI Key:
WZKJVDAVEBGOMU-UHFFFAOYSA-N
EC Number:
265-909-9
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.052g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
256.276g/mol
Monoisotopic Mass:
256.052g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
85.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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