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Home > Nitro Compounds > 127188-35-6
127188-35-6 | Carbamic acid, N-2-thiazolyl-, 4-nitrophenyl ester
CAS No: 127188-35-6 Catalog No: AG000WQY MDL No:
Product Description
Catalog Number:
AG000WQY
Chemical Name:
Carbamic acid, N-2-thiazolyl-, 4-nitrophenyl ester
CAS Number:
127188-35-6
Molecular Formula:
C10H7N3O4S
Molecular Weight:
265.2453
IUPAC Name:
(4-nitrophenyl) N-(1,3-thiazol-2-yl)carbamate
InChI:
InChI=1S/C10H7N3O4S/c14-10(12-9-11-5-6-18-9)17-8-3-1-7(2-4-8)13(15)16/h1-6H,(H,11,12,14)
InChI Key:
TWTOHGOPIJGUBM-UHFFFAOYSA-N
SMILES:
O=C(Nc1nccs1)Oc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.016g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.243g/mol
Monoisotopic Mass:
265.016g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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