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88485-15-8 | Hydrazinecarbothioamide, 2-(hexahydro-1H-pyrrolizin-1-ylidene)-
CAS No: 88485-15-8 Catalog No: AG0049W8 MDL No:
Product Description
Catalog Number:
AG0049W8
Chemical Name:
Hydrazinecarbothioamide, 2-(hexahydro-1H-pyrrolizin-1-ylidene)-
CAS Number:
88485-15-8
Molecular Formula:
C8H14N4S
Molecular Weight:
198.2886
IUPAC Name:
(2,3,5,6,7,8-hexahydropyrrolizin-1-ylideneamino)thiourea
InChI:
InChI=1S/C8H14N4S/c9-8(13)11-10-6-3-5-12-4-1-2-7(6)12/h7H,1-5H2,(H3,9,11,13)
InChI Key:
BRZBUMUCZBPCAW-UHFFFAOYSA-N
SMILES:
NC(=S)NN=C1CCN2C1CCC2
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.094g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
198.288g/mol
Monoisotopic Mass:
198.094g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
85.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
0.2
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