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Home > Nitro Compounds > 862822-06-8
862822-06-8 | Carbamic acid, (6-nitro-2-benzothiazolyl)-, 1,1-dimethylethyl ester
CAS No: 862822-06-8 Catalog No: AG00IDZX MDL No:
Product Description
Catalog Number:
AG00IDZX
Chemical Name:
Carbamic acid, (6-nitro-2-benzothiazolyl)-, 1,1-dimethylethyl ester
CAS Number:
862822-06-8
IUPAC Name:
tert-butyl N-(6-nitro-1,3-benzothiazol-2-yl)carbamate
InChI:
InChI=1S/C12H13N3O4S/c1-12(2,3)19-11(16)14-10-13-8-5-4-7(15(17)18)6-9(8)20-10/h4-6H,1-3H3,(H,13,14,16)
InChI Key:
GMZUPMHKXNVDNK-UHFFFAOYSA-N
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.063g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
295.313g/mol
Monoisotopic Mass:
295.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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