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Home > Thiazole > 1423031-39-3
1423031-39-3 | 1-(2,5-dimethyl-1,3-thiazol-4-yl)ethanone hydrochloride
CAS No: 1423031-39-3 Catalog No: AG00J1VX MDL No:MFCD22421828
Product Description
Catalog Number:
AG00J1VX
Chemical Name:
1-(2,5-dimethyl-1,3-thiazol-4-yl)ethanone hydrochloride
CAS Number:
1423031-39-3
Molecular Formula:
C7H10ClNOS
Molecular Weight:
191.6784
MDL Number:
MFCD22421828
IUPAC Name:
1-(2,5-dimethyl-1,3-thiazol-4-yl)ethanone;hydrochloride
InChI:
InChI=1S/C7H9NOS.ClH/c1-4(9)7-5(2)10-6(3)8-7;/h1-3H3;1H
InChI Key:
XZCXMHXUGDEAEW-UHFFFAOYSA-N
SMILES:
Cc1sc(c(n1)C(=O)C)C.Cl
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.017g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.673g/mol
Monoisotopic Mass:
191.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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