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1011408-00-6

1011408-00-6 | Benzoic acid, 4-(2-aminoethoxy)-3-methoxy-

CAS No: 1011408-00-6 Catalog No: AG0003UB MDL No:MFCD10039564

Product Description

Catalog Number:
AG0003UB
Chemical Name:
Benzoic acid, 4-(2-aminoethoxy)-3-methoxy-
CAS Number:
1011408-00-6
Molecular Formula:
C10H13NO4
Molecular Weight:
211.2145
MDL Number:
MFCD10039564
IUPAC Name:
4-(2-aminoethoxy)-3-methoxybenzoic acid
InChI:
InChI=1S/C10H13NO4/c1-14-9-6-7(10(12)13)2-3-8(9)15-5-4-11/h2-3,6H,4-5,11H2,1H3,(H,12,13)
InChI Key:
SDQRTNBCFGCDQU-UHFFFAOYSA-N
SMILES:
NCCOc1ccc(cc1OC)C(=O)O

Properties

Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.084g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.217g/mol
Monoisotopic Mass:
211.084g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6  

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