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17125-37-0 | 5-(sulfanylmethyl)imidazolidine-2,4-dione
CAS No: 17125-37-0 Catalog No: AG01C431 MDL No:MFCD04240847
Product Description
Catalog Number:
AG01C431
Chemical Name:
5-(sulfanylmethyl)imidazolidine-2,4-dione
CAS Number:
17125-37-0
Molecular Formula:
C4H6N2O2S
Molecular Weight:
146.1676
MDL Number:
MFCD04240847
IUPAC Name:
5-(sulfanylmethyl)imidazolidine-2,4-dione
InChI:
InChI=1S/C4H6N2O2S/c7-3-2(1-9)5-4(8)6-3/h2,9H,1H2,(H2,5,6,7,8)
InChI Key:
OTZNOKBPJBCNJO-UHFFFAOYSA-N
SMILES:
SCC1NC(=O)NC1=O
NSC Number:
121352
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.015g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
146.164g/mol
Monoisotopic Mass:
146.015g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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