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776278-33-2 | Methanedithiol, (1,3-diethyl-1,3-dihydro-4,5-dimethyl-2H-imidazol-2-ylidene)- (9CI)
CAS No: 776278-33-2 Catalog No: AG0058SS MDL No:
Product Description
Catalog Number:
AG0058SS
Chemical Name:
Methanedithiol, (1,3-diethyl-1,3-dihydro-4,5-dimethyl-2H-imidazol-2-ylidene)- (9CI)
CAS Number:
776278-33-2
Molecular Formula:
C10H18N2S2
Molecular Weight:
230.3933
IUPAC Name:
(1,3-diethyl-4,5-dimethylimidazol-2-ylidene)methanedithiol
InChI:
InChI=1S/C10H18N2S2/c1-5-11-7(3)8(4)12(6-2)9(11)10(13)14/h13-14H,5-6H2,1-4H3
InChI Key:
FGVLMHXQJFNHIU-UHFFFAOYSA-N
SMILES:
CCn1c(C)c(n(c1=C(S)S)CC)C
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.091g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
230.388g/mol
Monoisotopic Mass:
230.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
8.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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