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2988-23-0 | Ethanol, 2-[(2-benzothiazolylmethyl)thio]- (7CI,8CI)
CAS No: 2988-23-0 Catalog No: AG00BPVK MDL No:
Product Description
Catalog Number:
AG00BPVK
Chemical Name:
Ethanol, 2-[(2-benzothiazolylmethyl)thio]- (7CI,8CI)
CAS Number:
2988-23-0
IUPAC Name:
2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanol
InChI:
InChI=1S/C10H11NOS2/c12-5-6-13-7-10-11-8-3-1-2-4-9(8)14-10/h1-4,12H,5-7H2
InChI Key:
ZWWUAUOJFNGRTG-UHFFFAOYSA-N
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.028g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.324g/mol
Monoisotopic Mass:
225.028g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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