Home Aminos 3-[(dimethylamino)methyl]benzene-1-carbothioamide hydrochloride

3-[(dimethylamino)methyl]benzene-1-carbothioamide hydrochloride

CAS No.:
1803599-73-6
Catalog Number:
AG01B1D9
Molecular Formula:
C10H15ClN2S
Molecular Weight:
230.7575
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Product Description
Catalog Number:
AG01B1D9
Chemical Name:
3-[(dimethylamino)methyl]benzene-1-carbothioamide hydrochloride
CAS Number:
1803599-73-6
Molecular Formula:
C10H15ClN2S
Molecular Weight:
230.7575
MDL Number:
MFCD27980895
IUPAC Name:
3-[(dimethylamino)methyl]benzenecarbothioamide;hydrochloride
InChI:
InChI=1S/C10H14N2S.ClH/c1-12(2)7-8-4-3-5-9(6-8)10(11)13;/h3-6H,7H2,1-2H3,(H2,11,13);1H
InChI Key:
YYCLLNGQEIROSA-UHFFFAOYSA-N
SMILES:
CN(Cc1cccc(c1)C(=S)N)C.Cl
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.064g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
230.754g/mol
Monoisotopic Mass:
230.064g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties