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144602-00-6 | Acetic acid, 2-(1,3-dithiolan-2-ylidene)hydrazide
CAS No: 144602-00-6 Catalog No: AG001JUF MDL No:
Product Description
Catalog Number:
AG001JUF
Chemical Name:
Acetic acid, 2-(1,3-dithiolan-2-ylidene)hydrazide
CAS Number:
144602-00-6
Molecular Formula:
C5H8N2OS2
Molecular Weight:
176.2598
IUPAC Name:
N-(1,3-dithiolan-2-ylideneamino)acetamide
InChI:
InChI=1S/C5H8N2OS2/c1-4(8)6-7-5-9-2-3-10-5/h2-3H2,1H3,(H,6,8)
InChI Key:
BJDCCIJUSZCVQQ-UHFFFAOYSA-N
SMILES:
CC(=O)NN=C1SCCS1
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.008g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.252g/mol
Monoisotopic Mass:
176.008g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
92.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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