(2R)-1,2,3,4-Tetrahydronaphthalen-2-amine

CAS Number: 21966-60-9
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N[C@H](CC1)Cc2c1cccc2
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C10H13N
Molecular Weight
147.22
Drug-likeness
-2.5037
CAS
21966-60-9
InChI key
LCGFVWKNXLRFIF-SNVBAGLBSA-N
SMILES
N[C@H](CC1)Cc2c1cccc2
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 21966-60-9
Molecule Name (2R)-1,2,3,4-Tetrahydronaphthalen-2-amine
Molecular Formula C10H13N
SMILES N[C@H](CC1)Cc2c1cccc2
InChI InChI=1S/C10H13N/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-4,10H,5-7,11H2/t10-/m1/s1
InChI Key LCGFVWKNXLRFIF-SNVBAGLBSA-N
CanonicalSyTyLFy 956acb6b2a53bd8c
TotalMolweight 147.22
Molecular Weight 147.22
MonoisotopicMass 147.104799
CLogP 1.5665
CLogS -2.385
H Acceptors 1
H Donors 1
TotalSurfaceArea 122.06
Relative PSA 0.1251
PolarSurfaceArea 26.02
Drug-likeness -2.5037
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.63636
Molecula Flexibility 0.11109
Molecular Complexity 0.67959
Fragments 1
Non HAtoms 11
NonCHAtoms 1
Electronegative Atoms 1
StereoCenters 1
Rings Closures 2
Small Rings 2
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 5
Amines 1
AlkylAmines 1
BasicNitrogens 1
StereoCon this enantiomer

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