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765895-65-6 | (R)-3-Amino-3-(3-methoxyphenyl)propanoic acid
CAS No: 765895-65-6 Catalog No: AG005KC3 MDL No:MFCD04113658
Product Description
Catalog Number:
AG005KC3
Chemical Name:
(R)-3-Amino-3-(3-methoxyphenyl)propanoic acid
CAS Number:
765895-65-6
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD04113658
IUPAC Name:
(3R)-3-amino-3-(3-methoxyphenyl)propanoic acid
InChI:
InChI=1S/C10H13NO3/c1-14-8-4-2-3-7(5-8)9(11)6-10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)/t9-/m1/s1
InChI Key:
FGMPGCPZEOXEES-SECBINFHSA-N
SMILES:
COc1cccc(c1)[C@@H](CC(=O)O)N
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
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:
2
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
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