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Home > Thiazole > 1082669-81-5
1082669-81-5 | 5-methyl-2,3-dihydro-1,3-benzothiazole
CAS No: 1082669-81-5 Catalog No: AG01BQAI MDL No:MFCD30501191
Product Description
Catalog Number:
AG01BQAI
Chemical Name:
5-methyl-2,3-dihydro-1,3-benzothiazole
CAS Number:
1082669-81-5
Molecular Formula:
C8H9NS
Molecular Weight:
151.2288
MDL Number:
MFCD30501191
IUPAC Name:
5-methyl-2,3-dihydro-1,3-benzothiazole
InChI:
InChI=1S/C8H9NS/c1-6-2-3-8-7(4-6)9-5-10-8/h2-4,9H,5H2,1H3
InChI Key:
YOCNSWXEHXJBSF-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)NCS2
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.046g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.227g/mol
Monoisotopic Mass:
151.046g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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