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1171981-10-4 | 4-Thiazolemethanamine, 2-(1-methylethyl)-, hydrochloride (1:2)
CAS No: 1171981-10-4 Catalog No: AG000DWI MDL No:MFCD08275729
Product Description
Catalog Number:
AG000DWI
Chemical Name:
4-Thiazolemethanamine, 2-(1-methylethyl)-, hydrochloride (1:2)
CAS Number:
1171981-10-4
Molecular Formula:
C7H14Cl2N2S
Molecular Weight:
229.1705
MDL Number:
MFCD08275729
IUPAC Name:
(2-propan-2-yl-1,3-thiazol-4-yl)methanamine;dihydrochloride
InChI:
InChI=1S/C7H12N2S.2ClH/c1-5(2)7-9-6(3-8)4-10-7;;/h4-5H,3,8H2,1-2H3;2*1H
InChI Key:
FFYQRDDCOHMJTM-UHFFFAOYSA-N
SMILES:
NCc1csc(n1)C(C)C.Cl.Cl
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
229.163g/mol
Monoisotopic Mass:
228.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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