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(3S)-3-amino-3-(naphthalen-2-yl)propanoic acid

(3S)-3-amino-3-(naphthalen-2-yl)propanoic acid

CAS: 767282-94-0

Formula: C13H13NO2

SMILES: N[C@@H](CC(O)=O)C1=CC2=CC=CC=C2C=C1

IUPAC: (3S)-3-amino-3-(naphthalen-2-yl)propanoic acid

InChI: InChI=1S/C13H13NO2/c14-12(8-13(15)16)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12H,8,14H2,(H,15,16)/t12-/m0/s1

Composition: C (72.54%), H (6.09%), N (6.51%), O (14.87%)

Molar Mass: 215.252

Atom Count: 29

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 215.094628663
Formal Charge 0
FSP3 0.15
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey JASNXOXPNZWQRV-LBPRGKRZSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.44
Topological Polar Surface Area 63.32
Polarizability 25.42
Ring Count 2
Rotatable Bond Count 3

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99% <5 Days 767282-94-0 $146.28-$435.05$146.28$243.37$435.05
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