Completing data — usually done within a minute
Basic information
- CAS
21035-54-1- Standard SMILES
CC=CCN- InChIKey
QFUSOYKIDBRREL-UHFFFAOYSA-N- Molecular formula
- C4H9N
- Average molar mass
- 71.12 g/mol
- Monoisotopic mass
- 71.07349929
Names & identifiers
- Preferred name
- 2-Buten-1-amine
- IUPAC
- but-2-en-1-amine
Names & synonyms
2-Buten-1-amine21035-54-1RefChem:1062538aminobut-2-ene3-methylallylamine58887-05-1(Z)-but-2-en-1-amineSCHEMBL131258SCHEMBL131259SCHEMBL5184698SCHEMBL5699171SCHEMBL6636139
Show more names
SCHEMBL7136959SCHEMBL9446194SCHEMBL10466472SCHEMBL10466928SCHEMBL28157084DTXSID40870729QFUSOYKIDBRREL-UHFFFAOYSA-NAKOS026743865
Database identifiers
- CAS
21035-54-1- PubChem CID
- 30447
- DTXSID
DTXSID40870729
Properties
Computed structural propertiesFilling in
- XLogP
- 0.2
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 30.6
Related reactions
33 records
Compound notes
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