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17767-71-4 | Carbamic acid, methyl-, 4-benzothiazolyl ester (8CI)
CAS No: 17767-71-4 Catalog No: AG00AWHO MDL No:
Product Description
Catalog Number:
AG00AWHO
Chemical Name:
Carbamic acid, methyl-, 4-benzothiazolyl ester (8CI)
CAS Number:
17767-71-4
IUPAC Name:
1,3-benzothiazol-4-yl N-methylcarbamate
InChI:
InChI=1S/C9H8N2O2S/c1-10-9(12)13-6-3-2-4-7-8(6)11-5-14-7/h2-5H,1H3,(H,10,12)
InChI Key:
YSTAAMZYDLWSJX-UHFFFAOYSA-N
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.031g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.235g/mol
Monoisotopic Mass:
208.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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