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121896-53-5 | 2-Butenoic acid, 4-(trimethylsilyl)-, methyl ester
CAS No: 121896-53-5 Catalog No: AG0016CA MDL No:
Product Description
Catalog Number:
AG0016CA
Chemical Name:
2-Butenoic acid, 4-(trimethylsilyl)-, methyl ester
CAS Number:
121896-53-5
Molecular Formula:
C8H16O2Si
Molecular Weight:
172.2969
IUPAC Name:
methyl 4-trimethylsilylbut-2-enoate
InChI:
InChI=1S/C8H16O2Si/c1-10-8(9)6-5-7-11(2,3)4/h5-6H,7H2,1-4H3
InChI Key:
BPJYNOWIOGHRNG-UHFFFAOYSA-N
SMILES:
COC(=O)C=CC[Si](C)(C)C
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.092g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.299g/mol
Monoisotopic Mass:
172.092g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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