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1049769-51-8 | 3-[(4-methylphenyl)methyl]-2,3-dihydro-1,3-thiazol-2-imine hydrochloride
CAS No: 1049769-51-8 Catalog No: AG019IT3 MDL No:MFCD07286207
Product Description
Catalog Number:
AG019IT3
Chemical Name:
3-[(4-methylphenyl)methyl]-2,3-dihydro-1,3-thiazol-2-imine hydrochloride
CAS Number:
1049769-51-8
Molecular Formula:
C11H13ClN2S
Molecular Weight:
240.7523
MDL Number:
MFCD07286207
IUPAC Name:
3-[(4-methylphenyl)methyl]-1,3-thiazol-2-imine;hydrochloride
InChI:
InChI=1S/C11H12N2S.ClH/c1-9-2-4-10(5-3-9)8-13-6-7-14-11(13)12;/h2-7,12H,8H2,1H3;1H
InChI Key:
YKIWDZZMCGAPJH-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)Cn1ccsc1=N.Cl
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.049g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
240.749g/mol
Monoisotopic Mass:
240.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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