Home Carbonyls 4-((ethoxycarbonyl)(methyl)amino)butanoic acid

4-((ethoxycarbonyl)(methyl)amino)butanoic acid

CAS No.:
1152498-18-4
Catalog Number:
AG01BTZR
Molecular Formula:
C8H15NO4
Molecular Weight:
189.2090
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Product Description
Catalog Number:
AG01BTZR
Chemical Name:
4-((ethoxycarbonyl)(methyl)amino)butanoic acid
CAS Number:
1152498-18-4
Molecular Formula:
C8H15NO4
Molecular Weight:
189.2090
MDL Number:
MFCD11104051
IUPAC Name:
4-[ethoxycarbonyl(methyl)amino]butanoic acid
InChI:
InChI=1S/C8H15NO4/c1-3-13-8(12)9(2)6-4-5-7(10)11/h3-6H2,1-2H3,(H,10,11)
InChI Key:
DDHVBMNBIVTRMI-UHFFFAOYSA-N
SMILES:
CN(C(=O)OCC)CCCC(=O)O
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.1g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.211g/mol
Monoisotopic Mass:
189.1g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties