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91949-98-3 | 2-Benzothiazolemethanol,alpha-ethyl-(7CI,9CI)
CAS No: 91949-98-3 Catalog No: AG00H540 MDL No:
Product Description
Catalog Number:
AG00H540
Chemical Name:
2-Benzothiazolemethanol,alpha-ethyl-(7CI,9CI)
CAS Number:
91949-98-3
IUPAC Name:
1-(1,3-benzothiazol-2-yl)propan-1-ol
InChI:
InChI=1S/C10H11NOS/c1-2-8(12)10-11-7-5-3-4-6-9(7)13-10/h3-6,8,12H,2H2,1H3
InChI Key:
VCCWOBVVQHFRGS-UHFFFAOYSA-N
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.056g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.264g/mol
Monoisotopic Mass:
193.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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