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3004-59-9 | Propanamide, N-2-benzothiazolyl- (9CI)
CAS No: 3004-59-9 Catalog No: AG00BWFB MDL No:
Product Description
Catalog Number:
AG00BWFB
Chemical Name:
Propanamide, N-2-benzothiazolyl- (9CI)
CAS Number:
3004-59-9
IUPAC Name:
N-(1,3-benzothiazol-2-yl)propanamide
InChI:
InChI=1S/C10H10N2OS/c1-2-9(13)12-10-11-7-5-3-4-6-8(7)14-10/h3-6H,2H2,1H3,(H,11,12,13)
InChI Key:
RYWYJGXIHQNKFE-UHFFFAOYSA-N
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.051g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.263g/mol
Monoisotopic Mass:
206.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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