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32864-38-3 | tert-Butyl ethyl malonate
CAS No: 32864-38-3 Catalog No: AG003UKN MDL No:MFCD00009193
Product Description
Catalog Number:
AG003UKN
Chemical Name:
tert-Butyl ethyl malonate
CAS Number:
32864-38-3
Molecular Formula:
C9H16O4
Molecular Weight:
188.2209
MDL Number:
MFCD00009193
IUPAC Name:
3-O-tert-butyl 1-O-ethyl propanedioate
InChI:
InChI=1S/C9H16O4/c1-5-12-7(10)6-8(11)13-9(2,3)4/h5-6H2,1-4H3
InChI Key:
OCOBFMZGRJOSOU-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(=O)OC(C)(C)C
EC Number:
251-269-8
NSC Number:
69070
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.105g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.223g/mol
Monoisotopic Mass:
188.105g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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