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125481-81-4 | Carbamic acid, methyl(1-oxoundecyl)-, methyl ester (9CI)
CAS No: 125481-81-4 Catalog No: AG000NQP MDL No:
Product Description
Catalog Number:
AG000NQP
Chemical Name:
Carbamic acid, methyl(1-oxoundecyl)-, methyl ester (9CI)
CAS Number:
125481-81-4
Molecular Formula:
C14H27NO3
Molecular Weight:
257.3691
IUPAC Name:
methyl N-methyl-N-undecanoylcarbamate
InChI:
InChI=1S/C14H27NO3/c1-4-5-6-7-8-9-10-11-12-13(16)15(2)14(17)18-3/h4-12H2,1-3H3
InChI Key:
XXYRKSGPJAUKLK-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCC(=O)N(C(=O)OC)C
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.199g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.374g/mol
Monoisotopic Mass:
257.199g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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