chempirical

(2S)-2-Benzylaziridine

C9H11NCAS 73058-30-7133.19 g/mol

Open in Covalent MOL file
HN
Secondary amine

Properties

Molecular formula
C9H11N
Molar mass
133.19 g/mol
Exact mass
133.0891 Da
logP
1.20Crippen estimate
Polar surface area
21.9 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2
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
73058-30-7
SMILES
C1[C@@H](N1)CC2=CC=CC=C2
InChIKey
LKQAJXTWYDNYHK-VIFPVBQESA-N
InChI
InChI=1S/C9H11N/c1-2-4-8(5-3-1)6-9-7-10-9/h1-5,9-10H,6-7H2/t9-/m0/s1

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Names and synonyms

1 names
  • (S)-2-Benzyl-aziridine

Work with (2S)-2-Benzylaziridine

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

Similar compounds

2-Benzylpiperidine32838-55-454 % similar Isobutylbenzene538-93-248 % similar 4-Benzylpiperidine31252-42-346 % similar 3-Benzylpiperidine13603-25-345 % similar 2-Benzyl-3-phenylaziridine1605-08-945 % similar Methamphetamine537-46-245 % similar 1,2-Diphenylethyl-N-methylamine53663-25-543 % similar Phenylacetaldehyde dimethyl acetal101-48-443 % similar

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

Same formula

(R)-(-)-1-Aminoindan10277-74-4 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 (±)-1-Aminoindan34698-41-4

Elsewhere

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