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17583-14-1 | 2-Methyl-5,6-dihydrobenzo[d]thiazol-7(4H)-one
CAS No: 17583-14-1 Catalog No: AG00B63T MDL No:MFCD08753882
Product Description
Catalog Number:
AG00B63T
Chemical Name:
2-Methyl-5,6-dihydrobenzo[d]thiazol-7(4H)-one
CAS Number:
17583-14-1
Molecular Formula:
C8H9NOS
Molecular Weight:
167.2282
MDL Number:
MFCD08753882
IUPAC Name:
2-methyl-5,6-dihydro-4H-1,3-benzothiazol-7-one
InChI:
InChI=1S/C8H9NOS/c1-5-9-6-3-2-4-7(10)8(6)11-5/h2-4H2,1H3
InChI Key:
QFTUPSZZEJQOJX-UHFFFAOYSA-N
SMILES:
Cc1nc2c(s1)C(=O)CCC2
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.04g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.226g/mol
Monoisotopic Mass:
167.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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