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Home Aminos Benzeneacetic acid, α-amino-4-methoxy-, methyl ester, hydrochloride (1:1)

Benzeneacetic acid, α-amino-4-methoxy-, methyl ester, hydrochloride (1:1)

CAS No.:
13226-99-8
Catalog Number:
AG0010GR
Molecular Formula:
C10H14ClNO3
Molecular Weight:
231.6761
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Product Description
Catalog Number:
AG0010GR
Chemical Name:
Benzeneacetic acid, α-amino-4-methoxy-, methyl ester, hydrochloride (1:1)
CAS Number:
13226-99-8
Molecular Formula:
C10H14ClNO3
Molecular Weight:
231.6761
MDL Number:
MFCD09152735
IUPAC Name:
methyl 2-amino-2-(4-methoxyphenyl)acetate;hydrochloride
InChI:
InChI=1S/C10H13NO3.ClH/c1-13-8-5-3-7(4-6-8)9(11)10(12)14-2;/h3-6,9H,11H2,1-2H3;1H
InChI Key:
VUEACPSVBZTUCV-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1ccc(cc1)OC)N.Cl
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.066g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.676g/mol
Monoisotopic Mass:
231.066g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties