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73675-24-8 | Butanoic acid, 4-[[2-[[2-(ethylthio)ethyl]thio]ethyl]amino]-4-oxo-
CAS No: 73675-24-8 Catalog No: AG005BZI MDL No:
Product Description
Catalog Number:
AG005BZI
Chemical Name:
Butanoic acid, 4-[[2-[[2-(ethylthio)ethyl]thio]ethyl]amino]-4-oxo-
CAS Number:
73675-24-8
Molecular Formula:
C10H19NO3S2
Molecular Weight:
265.3928
IUPAC Name:
4-[2-(2-ethylsulfanylethylsulfanyl)ethylamino]-4-oxobutanoic acid
InChI:
InChI=1S/C10H19NO3S2/c1-2-15-7-8-16-6-5-11-9(12)3-4-10(13)14/h2-8H2,1H3,(H,11,12)(H,13,14)
InChI Key:
JKWCLUQRWDPQBT-UHFFFAOYSA-N
SMILES:
CCSCCSCCNC(=O)CCC(=O)O
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.081g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
265.386g/mol
Monoisotopic Mass:
265.081g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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