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999-72-4 | N,N'-Dimethyl-3,3'-dithiodipropionamide
CAS No: 999-72-4 Catalog No: AG003698 MDL No:MFCD00172796
Product Description
Catalog Number:
AG003698
Chemical Name:
N,N'-Dimethyl-3,3'-dithiodipropionamide
CAS Number:
999-72-4
Molecular Formula:
C8H16N2O2S2
Molecular Weight:
236.3548
MDL Number:
MFCD00172796
IUPAC Name:
N-methyl-3-[[3-(methylamino)-3-oxopropyl]disulfanyl]propanamide
InChI:
InChI=1S/C8H16N2O2S2/c1-9-7(11)3-5-13-14-6-4-8(12)10-2/h3-6H2,1-2H3,(H,9,11)(H,10,12)
InChI Key:
QUHFFYTTZGTUQQ-UHFFFAOYSA-N
SMILES:
CNC(=O)CCSSCCC(=O)NC
EC Number:
213-665-9
UNII:
F5OV03L720
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.065g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.348g/mol
Monoisotopic Mass:
236.065g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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