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132224-97-6 | Acetic acid, 2-[4-(aminomethyl)phenoxy]-, methyl ester
CAS No: 132224-97-6 Catalog No: AG0010F3 MDL No:
Product Description
Catalog Number:
AG0010F3
Chemical Name:
Acetic acid, 2-[4-(aminomethyl)phenoxy]-, methyl ester
CAS Number:
132224-97-6
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
IUPAC Name:
methyl 2-[4-(aminomethyl)phenoxy]acetate
InChI:
InChI=1S/C10H13NO3/c1-13-10(12)7-14-9-4-2-8(6-11)3-5-9/h2-5H,6-7,11H2,1H3
InChI Key:
RPHMGDRRIKVJGN-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)OCC(=O)OC
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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