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125229-15-4

125229-15-4 | Benzoic acid, 3-amino-5-(methoxymethoxy)-4-methyl-, methyl ester

CAS No: 125229-15-4 Catalog No: AG000NDB MDL No:

Product Description

Catalog Number:
AG000NDB
Chemical Name:
Benzoic acid, 3-amino-5-(methoxymethoxy)-4-methyl-, methyl ester
CAS Number:
125229-15-4
Molecular Formula:
C11H15NO4
Molecular Weight:
225.2411
IUPAC Name:
methyl 3-amino-5-(methoxymethoxy)-4-methylbenzoate
InChI:
InChI=1S/C11H15NO4/c1-7-9(12)4-8(11(13)15-3)5-10(7)16-6-14-2/h4-5H,6,12H2,1-3H3
InChI Key:
RLRXKWMMMDGSQI-UHFFFAOYSA-N
SMILES:
COCOc1cc(cc(c1C)N)C(=O)OC

Properties

Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.1g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.244g/mol
Monoisotopic Mass:
225.1g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
70.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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