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21076-10-8 | Hydrazinecarbothioamide, N-methyl-1-phenyl-
CAS No: 21076-10-8 Catalog No: AG002KZ0 MDL No:
Product Description
Catalog Number:
AG002KZ0
Chemical Name:
Hydrazinecarbothioamide, N-methyl-1-phenyl-
CAS Number:
21076-10-8
Molecular Formula:
C8H11N3S
Molecular Weight:
181.2580
IUPAC Name:
1-amino-3-methyl-1-phenylthiourea
InChI:
InChI=1S/C8H11N3S/c1-10-8(12)11(9)7-5-3-2-4-6-7/h2-6H,9H2,1H3,(H,10,12)
InChI Key:
HKVXECWFBMCLEF-UHFFFAOYSA-N
SMILES:
CNC(=S)N(c1ccccc1)N
NSC Number:
174134
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.067g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
181.257g/mol
Monoisotopic Mass:
181.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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