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Home > Amines > 183288-42-8

183288-42-8

183288-42-8 | 2-Benzofurancarboxylic acid, 5-amino-, ethyl ester, hydrochloride (1:1)

CAS No: 183288-42-8 Catalog No: AG0027GI MDL No:MFCD22574189

Product Description

Catalog Number:
AG0027GI
Chemical Name:
2-Benzofurancarboxylic acid, 5-amino-, ethyl ester, hydrochloride (1:1)
CAS Number:
183288-42-8
Molecular Formula:
C11H12ClNO3
Molecular Weight:
241.6709
MDL Number:
MFCD22574189
IUPAC Name:
ethyl 5-amino-1-benzofuran-2-carboxylate;hydrochloride
InChI:
InChI=1S/C11H11NO3.ClH/c1-2-14-11(13)10-6-7-5-8(12)3-4-9(7)15-10;/h3-6H,2,12H2,1H3;1H
InChI Key:
XGGIUALENXNONX-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2c(o1)ccc(c2)N.Cl

Properties

Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
241.671g/mol
Monoisotopic Mass:
241.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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