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6278-70-2 | Benzothiazole, 2-(2-propenyl)- (9CI)
CAS No: 6278-70-2 Catalog No: AG00EOA1 MDL No:
Product Description
Catalog Number:
AG00EOA1
Chemical Name:
Benzothiazole, 2-(2-propenyl)- (9CI)
CAS Number:
6278-70-2
IUPAC Name:
2-prop-2-enyl-1,3-benzothiazole
InChI:
InChI=1S/C10H9NS/c1-2-5-10-11-8-6-3-4-7-9(8)12-10/h2-4,6-7H,1,5H2
InChI Key:
RAFWJRCRFYTEFF-UHFFFAOYSA-N
NSC Number:
34441
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.046g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.249g/mol
Monoisotopic Mass:
175.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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