(S)-(+)-1-Aminoindan

C₉H₁₁NCAS 61341-86-4133.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₁N
Molar mass: 133.19 g/mol
Exact mass: 133.0891 Da
logP: 1.63Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0
Stereocentres: Sin SMILES atom order

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers
H412 Harmful to aquatic life with long lasting effects90.9% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

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 1-Aminoindane hydrochloride70146-15-5Salt, stereo not defined (R)-2,3-Dihydro-1H-inden-1-amine hydrochloride10305-73-4Salt, enantiomer

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 Indan-5-amine24425-40-9 2-Aminoindane2975-41-9 4-Cyclopropylaniline3158-71-2 4-Aminoindane32202-61-2

Elsewhere

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