Basic information
- CAS
107610-62-8- Standard SMILES
CC1CNCC1CN- InChIKey
NMWWGQKXOXJVOE-UHFFFAOYSA-N- Molecular formula
- C6H14N2
- Average molar mass
- 114.19 g/mol
- Monoisotopic mass
- 114.11569845
Names & identifiers
- Preferred name
- (4-Methylpyrrolidin-3-yl)methanamine
- IUPAC
- (4-methylpyrrolidin-3-yl)methanamine
- English name
- 4-Methyl-3-PyrrolidineMethanaMine
- Molecular formula
- C6H14N2
- Molecular weight
- 114.19
Names & synonyms
(4-methylpyrrolidin-3-yl)methanamine107610-62-8C-(4-METHYL-PYRROLIDIN-3-YL)-METHYLAMINESCHEMBL1859284SCHEMBL103759893-aminomethyl-4-methylpyrrolidineDTXSID00404524NMWWGQKXOXJVOE-UHFFFAOYSA-NAKOS0130262201-(4-Methylpyrrolidin-3-yl)methanamineEN300-359955H54502
Show more names
4-Methyl-3-PyrrolidineMethanaMine3-Pyrrolidinemethanamine, 4-methyl-
M33000
Database identifiers
- CAS
107610-62-8- PubChem CID
- 4583498
- DTXSID
DTXSID00404524
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 72.9
Physicochemical properties
- Boiling point
- 71 · 71-86 °C(Press: 29 Torr)
- Density
- 0.881 · 0.881±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 10.23 · 10.23±0.10(Predicted)
Chemistry & industry
Suppliers1 total
上海书亚医药科技有限公司400-685-9117 · [email protected]
Related reactions
12 records
Compound notes
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