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2049-70-9 | Propanedioic acid, 2-ethyl-2-methyl-, 1,3-diethyl ester
CAS No: 2049-70-9 Catalog No: AG0029R2 MDL No:MFCD02258541
Product Description
Catalog Number:
AG0029R2
Chemical Name:
Propanedioic acid, 2-ethyl-2-methyl-, 1,3-diethyl ester
CAS Number:
2049-70-9
Molecular Formula:
C10H18O4
Molecular Weight:
202.2475
MDL Number:
MFCD02258541
IUPAC Name:
diethyl 2-ethyl-2-methylpropanedioate
InChI:
InChI=1S/C10H18O4/c1-5-10(4,8(11)13-6-2)9(12)14-7-3/h5-7H2,1-4H3
InChI Key:
ODRGILDUWDVBJX-UHFFFAOYSA-N
SMILES:
CCC(C(=O)OCC)(C(=O)OCC)C
EC Number:
218-070-8
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.25g/mol
Monoisotopic Mass:
202.121g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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