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Diethyl 5,5'-methylenedianthranilate

HCID 84895
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Basic information

CAS
15403-44-8
Standard SMILES
CCOC(=O)c1cc(Cc2ccc(N)c(C(=O)OCC)c2)ccc1N
InChIKey
HQNXNKDEVVRPSA-UHFFFAOYSA-N
Molecular formula
C19H22N2O4
Average molar mass
342.4 g/mol
Monoisotopic mass
342.15795719

Names & identifiers

Preferred name
Diethyl 5,5'-methylenedianthranilate
IUPAC
ethyl 2-amino-5-[(4-amino-3-ethoxycarbonylphenyl)methyl]benzoate
English name
diethyl 5,5'-methylenedianthranilate
Molecular formula
C19H22N2O4
Molecular weight
342.38898

Names & synonyms

Diethyl 5,5'-methylenedianthranilate15403-44-8ethyl 2-amino-5-[(4-amino-3-ethoxycarbonylphenyl)methyl]benzoate3,3'-Di(ethoxycarbonyl)-4,4'-diaminodiphenylmethanediethyl 3,3'-methylenebis(6-aminobenzoate)Diethyl 5,5/'-methylenedianthranilateCCRIS 8072EINECS 239-419-0SCHEMBL9802167DTXSID40165521HQNXNKDEVVRPSA-UHFFFAOYSA-N4,4'-methylenebis(o-carboethoxyaniline)
Show more names
3,3'-Methylenebis[6-aminobenzoic acid]diethyl esterBenzoic acid, 3,3'-methylenebis[6-amino-, diethyl ester (9CI)
NS00025005

Database identifiers

CAS
15403-44-8
PubChem CID
84895
DTXSID
DTXSID40165521
EC Number
239-419-0
Nikkaji
J218.418D

Properties

Computed structural properties

XLogP
4
Topological polar surface area
105 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
25
Formal charge
0
Complexity
417

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