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87932-39-6 | Ethanamine, 2-[[2-(trimethylsilyl)ethyl]thio]-, (2Z)-2-butenedioate (1:1)
CAS No: 87932-39-6 Catalog No: AG004GSQ MDL No:
Product Description
Catalog Number:
AG004GSQ
Chemical Name:
Ethanamine, 2-[[2-(trimethylsilyl)ethyl]thio]-, (2Z)-2-butenedioate (1:1)
CAS Number:
87932-39-6
Molecular Formula:
C11H23NO4SSi
Molecular Weight:
293.4551
IUPAC Name:
but-2-enedioic acid;2-(2-trimethylsilylethylsulfanyl)ethanamine
InChI:
InChI=1S/C7H19NSSi.C4H4O4/c1-10(2,3)7-6-9-5-4-8;5-3(6)1-2-4(7)8/h4-8H2,1-3H3;1-2H,(H,5,6)(H,7,8)
InChI Key:
KZZNGPAELKNPIC-UHFFFAOYSA-N
SMILES:
OC(=O)/C=C\C(=O)O.NCCSCC[Si](C)(C)C
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.112g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
293.453g/mol
Monoisotopic Mass:
293.112g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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