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Home > Imidazoles > 97403-83-3
97403-83-3 | 3-allyl-1-methyl-2-thioxoimidazolidin-4-one
CAS No: 97403-83-3 Catalog No: AG00JF1Y MDL No:MFCD02602432
Product Description
Catalog Number:
AG00JF1Y
Chemical Name:
3-allyl-1-methyl-2-thioxoimidazolidin-4-one
CAS Number:
97403-83-3
Molecular Formula:
C7H10N2OS
Molecular Weight:
170.2321
MDL Number:
MFCD02602432
IUPAC Name:
1-methyl-3-prop-2-enyl-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C7H10N2OS/c1-3-4-9-6(10)5-8(2)7(9)11/h3H,1,4-5H2,2H3
InChI Key:
CSOZJWJXTNWDRD-UHFFFAOYSA-N
SMILES:
C=CCN1C(=O)CN(C1=S)C
EC Number:
306-745-0
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.051g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.23g/mol
Monoisotopic Mass:
170.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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