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144207-27-2 | Aspartic acid, N-methyl-N-(1-oxododecyl)-, dimethyl ester (9CI)
CAS No: 144207-27-2 Catalog No: AG001J3R MDL No:
Product Description
Catalog Number:
AG001J3R
Chemical Name:
Aspartic acid, N-methyl-N-(1-oxododecyl)-, dimethyl ester (9CI)
CAS Number:
144207-27-2
Molecular Formula:
C19H35NO5
Molecular Weight:
357.4849
IUPAC Name:
dimethyl 2-[dodecanoyl(methyl)amino]butanedioate
InChI:
InChI=1S/C19H35NO5/c1-5-6-7-8-9-10-11-12-13-14-17(21)20(2)16(19(23)25-4)15-18(22)24-3/h16H,5-15H2,1-4H3
InChI Key:
USFLVQQRTYULFT-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC(=O)N([C@H](C(=O)OC)CC(=O)OC)C
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.252g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
357.491g/mol
Monoisotopic Mass:
357.252g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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