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Home > Nitro Compounds > 338396-17-1
338396-17-1 | 4-[(4-nitrophenyl)carbamoyl]phenyl N,N-dimethylsulfamate
CAS No: 338396-17-1 Catalog No: AG00IXQY MDL No:MFCD00140673
Product Description
Catalog Number:
AG00IXQY
Chemical Name:
4-[(4-nitrophenyl)carbamoyl]phenyl N,N-dimethylsulfamate
CAS Number:
338396-17-1
Molecular Formula:
C15H15N3O6S
Molecular Weight:
365.3611
MDL Number:
MFCD00140673
IUPAC Name:
[4-[(4-nitrophenyl)carbamoyl]phenyl] N,N-dimethylsulfamate
InChI:
InChI=1S/C15H15N3O6S/c1-17(2)25(22,23)24-14-9-3-11(4-10-14)15(19)16-12-5-7-13(8-6-12)18(20)21/h3-10H,1-2H3,(H,16,19)
InChI Key:
VIINMUUEYGBVJQ-UHFFFAOYSA-N
SMILES:
CN(S(=O)(=O)Oc1ccc(cc1)C(=O)Nc1ccc(cc1)[N+](=O)[O-])C
Properties
Complexity:
567
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.068g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
365.36g/mol
Monoisotopic Mass:
365.068g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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