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57114-72-4 | Benzothiazole, 2,3-dihydro-2-methylene- (9CI)
CAS No: 57114-72-4 Catalog No: AG00EOI7 MDL No:
Product Description
Catalog Number:
AG00EOI7
Chemical Name:
Benzothiazole, 2,3-dihydro-2-methylene- (9CI)
CAS Number:
57114-72-4
IUPAC Name:
2-methylidene-3H-1,3-benzothiazole
InChI:
InChI=1S/C8H7NS/c1-6-9-7-4-2-3-5-8(7)10-6/h2-5,9H,1H2
InChI Key:
UCIRJYREYJDVKS-UHFFFAOYSA-N
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.03g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
149.211g/mol
Monoisotopic Mass:
149.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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