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15441-06-2 | Dimethyl 3,3'-disulfanediyldipropanoate
CAS No: 15441-06-2 Catalog No: AG003PL9 MDL No:MFCD00128218
Product Description
Catalog Number:
AG003PL9
Chemical Name:
Dimethyl 3,3'-disulfanediyldipropanoate
CAS Number:
15441-06-2
Molecular Formula:
C8H14O4S2
Molecular Weight:
238.3244
MDL Number:
MFCD00128218
IUPAC Name:
methyl 3-[(3-methoxy-3-oxopropyl)disulfanyl]propanoate
InChI:
InChI=1S/C8H14O4S2/c1-11-7(9)3-5-13-14-6-4-8(10)12-2/h3-6H2,1-2H3
InChI Key:
OSZKBWPMEPEYFU-UHFFFAOYSA-N
SMILES:
COC(=O)CCSSCCC(=O)OC
EC Number:
239-452-0
NSC Number:
638709
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.033g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.316g/mol
Monoisotopic Mass:
238.033g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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