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89690-16-4 | Carbamic acid, [4-[(ethoxycarbonyl)amino]butyl]methyl-, ethyl ester
CAS No: 89690-16-4 Catalog No: AG00439A MDL No:
Product Description
Catalog Number:
AG00439A
Chemical Name:
Carbamic acid, [4-[(ethoxycarbonyl)amino]butyl]methyl-, ethyl ester
CAS Number:
89690-16-4
Molecular Formula:
C11H22N2O4
Molecular Weight:
246.3034
IUPAC Name:
ethyl N-[4-(ethoxycarbonylamino)butyl]-N-methylcarbamate
InChI:
InChI=1S/C11H22N2O4/c1-4-16-10(14)12-8-6-7-9-13(3)11(15)17-5-2/h4-9H2,1-3H3,(H,12,14)
InChI Key:
GCTIPPILAAZYHT-UHFFFAOYSA-N
SMILES:
CCOC(=O)NCCCCN(C(=O)OCC)C
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.158g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.307g/mol
Monoisotopic Mass:
246.158g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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