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122745-11-3 | 2-Naphthalenepropanoic acid, α-amino-, hydrochloride (1:1), (αR)-
CAS No: 122745-11-3 Catalog No: AG000J9C MDL No:MFCD03095596
Product Description
Catalog Number:
AG000J9C
Chemical Name:
2-Naphthalenepropanoic acid, α-amino-, hydrochloride (1:1), (αR)-
CAS Number:
122745-11-3
Molecular Formula:
C13H14ClNO2
Molecular Weight:
251.7088
MDL Number:
MFCD03095596
IUPAC Name:
(2R)-2-amino-3-naphthalen-2-ylpropanoic acid;hydrochloride
InChI:
InChI=1S/C13H13NO2.ClH/c14-12(13(15)16)8-9-5-6-10-3-1-2-4-11(10)7-9;/h1-7,12H,8,14H2,(H,15,16);1H/t12-;/m1./s1
InChI Key:
QXEYSNIVQNSZGX-UTONKHPSSA-N
SMILES:
OC(=O)[C@@H](Cc1ccc2c(c1)cccc2)N.Cl
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
251.071g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
251.71g/mol
Monoisotopic Mass:
251.071g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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