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76033-78-8 | 1-Piperazinecarbothioamide,N,N,4-trimethyl-
CAS No: 76033-78-8 Catalog No: AG005GGZ MDL No:
Product Description
Catalog Number:
AG005GGZ
Chemical Name:
1-Piperazinecarbothioamide,N,N,4-trimethyl-
CAS Number:
76033-78-8
Molecular Formula:
C8H17N3S
Molecular Weight:
187.3057
IUPAC Name:
N,N,4-trimethylpiperazine-1-carbothioamide
InChI:
InChI=1S/C8H17N3S/c1-9(2)8(12)11-6-4-10(3)5-7-11/h4-7H2,1-3H3
InChI Key:
HIOSKZYJXVXCRK-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)C(=S)N(C)C
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.114g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.305g/mol
Monoisotopic Mass:
187.114g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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