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179626-68-7

179626-68-7 | Carbamic acid, 2-benzothiazolyl-, 1,1-dimethylethyl ester (9CI)

CAS No: 179626-68-7 Catalog No: AG00AWEI MDL No:

Product Description

Catalog Number:
AG00AWEI
Chemical Name:
Carbamic acid, 2-benzothiazolyl-, 1,1-dimethylethyl ester (9CI)
CAS Number:
179626-68-7
IUPAC Name:
tert-butyl N-(1,3-benzothiazol-2-yl)carbamate
InChI:
InChI=1S/C12H14N2O2S/c1-12(2,3)16-11(15)14-10-13-8-6-4-5-7-9(8)17-10/h4-7H,1-3H3,(H,13,14,15)
InChI Key:
JWQBIRJVULZPNO-UHFFFAOYSA-N

Properties

Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.078g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.316g/mol
Monoisotopic Mass:
250.078g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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