chempirical

(S)-(+)-1-Aminoindan

C9H11NCAS 61341-86-4133.19 g/mol

Open in Covalent MOL file
H2N
Primary amine

Properties

Molecular formula
C9H11N
Molar mass
133.19 g/mol
Exact mass
133.0891 Da
logP
1.63Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0
Stereocentres
Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
61341-86-4
SMILES
C1CC2=CC=CC=C2[C@H]1N
InChIKey
XJEVHMGJSYVQBQ-VIFPVBQESA-N
InChI
InChI=1S/C9H11N/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,9H,5-6,10H2/t9-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names
  • 1-Aminoindane, (S)-

Work with (S)-(+)-1-Aminoindan

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(R)-(-)-1-Aminoindan10277-74-4Enantiomer (±)-1-Aminoindan34698-41-4Stereo not defined (R)-2,3-Dihydro-1H-inden-1-amine hydrochloride10305-73-4Salt, enantiomer 1-Aminoindane hydrochloride70146-15-5Salt, stereo not defined

Similar compounds

1,2,3,4-Tetrahydro-1-naphthylamine2217-40-577 % similar (-)-1,2,3,4-Tetrahydro-1-naphthylamine23357-46-277 % similar (+)-1,2,3,4-Tetrahydro-1-naphthylamine23357-52-077 % similar 1,2,3,4-Tetrahydro-1-naphthylamine hydrochloride49800-23-969 % similar 1-Indanol6351-10-654 % similar (R)-Chroman-4-amine210488-55-447 % similar (S)-1,2,3,4-Tetrahydro-2-naphthylamine21880-87-547 % similar 2-Aminotetralin2954-50-947 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5,6,7,8-Tetrahydroquinoline10500-57-9 Tranylcypromine155-09-9 5-Aminoindan24425-40-9 2-Aminoindane2975-41-9 4-Cyclopropylaniline3158-71-2 4-Aminoindane32202-61-2

Elsewhere

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