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methyl(1,3-thiazol-4-ylmethyl)amine dihydrochloride

methyl(1,3-thiazol-4-ylmethyl)amine dihydrochloride

CAS: 1609403-13-5

Formula: C5H10Cl2N2S

SMILES: Cl.Cl.CNCC1=CSC=N1

IUPAC: methyl[(1,3-thiazol-4-yl)methyl]amine dihydrochloride

InChI: InChI=1S/C5H8N2S.2ClH/c1-6-2-5-3-8-4-7-5;;/h3-4,6H,2H2,1H3;2*1H

Composition: C (29.86%), H (5.01%), Cl (35.25%), N (13.93%), S (15.94%)

Molar Mass: 201.11

Atom Count: 20

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 199.9941749
Formal Charge 0
FSP3 0.4
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey UNDLNBKOVSAJHM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 33.99
Topological Polar Surface Area 24.92
Polarizability 13.31
Ring Count 1
Rotatable Bond Count 2

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