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91634-13-8 | 6-ethoxy-1,3-benzothiazole-2-carbonitrile
CAS No: 91634-13-8 Catalog No: AG00IGT0 MDL No:
Product Description
Catalog Number:
AG00IGT0
Chemical Name:
6-ethoxy-1,3-benzothiazole-2-carbonitrile
CAS Number:
91634-13-8
IUPAC Name:
6-ethoxy-1,3-benzothiazole-2-carbonitrile
InChI:
InChI=1S/C10H8N2OS/c1-2-13-7-3-4-8-9(5-7)14-10(6-11)12-8/h3-5H,2H2,1H3
InChI Key:
HYLRVONDRVTYHL-UHFFFAOYSA-N
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.036g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.247g/mol
Monoisotopic Mass:
204.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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