Acetone propylimine

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Basic information

CAS: 22023-64-9
Standard SMILES: CCCN=C(C)C
InChIKey: NBIJUKASRCFXDY-UHFFFAOYSA-N
Molecular formula: C6H13N
Average molar mass: 99.17 g/mol
Monoisotopic mass: 99.10479942

Names & identifiers

Preferred name: Acetone propylimine
IUPAC: N-propylpropan-2-imine

Names & synonyms

Acetone propylimineN-propylpropan-2-imine22023-64-9WP10440M6MUNII-WP10440M6MDTXSID00176491RefChem:108999DTXCID4098982acetone N-propyliminen-C3H7N=C(CH3)2SCHEMBL1933279SCHEMBL1933281

Show more names

SCHEMBL2731154SCHEMBL6374261Q27292758

Database identifiers

CAS: 22023-64-9
PubChem CID: 140874
DTXSID: DTXSID00176491
UNII: WP10440M6M
Nikkaji: J1.703.946F

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 12.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 7
Formal charge: 0
Complexity: 60.6

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Compound notes

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