Basic information
- CAS
94107-99-0- Standard SMILES
CCCCN(CCCC)CCCN(CCCC)CCCC- InChIKey
GFQVCRLEDYPCAB-UHFFFAOYSA-N- Molecular formula
- C19H42N2
- Average molar mass
- 298.6 g/mol
- Monoisotopic mass
- 298.33479935
Names & identifiers
- Preferred name
- N,N,N',N'-Tetrabutylpropane-1,3-diamine
- IUPAC
- N,N,N',N'-tetrabutylpropane-1,3-diamine
- English name
- N,N,N',N'-tetrabutylpropane-1,3-diamine
- Molecular formula
- C19H42N2
- Molecular weight
- 298.55
Names & synonyms
N,N,N',N'-Tetrabutylpropane-1,3-diamine94107-99-0N,N,N',N'-Tetrabutyl-1,3-propanediamineNSC-19166NSC19166EINECS 302-336-6Dronedarone Impurity 41ZAC4V5NCG4N1,N1,N3,N3-Tetrabutylpropane-1,3-diamine1,3-Bis(dibutylamino)propaneSCHEMBL6664330DTXSID70240557
Show more names
Azetidine Impurity 11,3-PropanediaMine, N,N,N',N'-tetrabutyl-N,N,N',N'-Tetra-n-butyl-1,3-propanediamine
GFQVCRLEDYPCAB-UHFFFAOYSA-NNSC 19166NS00040041N1,N1,N3,N3-Tetrabutyl-1,3-propanediamine1,3-Propanediamine, N1,N1,N3,N3-tetrabutyl-N~1~,N~1~,N~3~,N~3~-Tetrabutylpropane-1,3-diamineN1,N1,N3,N3-Tetrabutyl-1,3-propanediamine; 1,3-Bis(dibutylamino)propane; N,N-Dibutylpropylenediamine; NSC 19166
Database identifiers
- CAS
94107-99-0- PubChem CID
- 95119
- DTXSID
DTXSID70240557- UNII
- ZAC4V5NCG4
- EC Number
- 302-336-6
- Nikkaji
- J318.701B
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 16
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 158
Physicochemical properties
- Boiling point
- 337.6 · 337.6±10.0 °C(Predicted)
- Density
- 0.837 · 0.837±0.06 g/cm3(Predicted)
- pka
- 10.04 · 10.04±0.50(Predicted)
- FDA UNII
- 4 V5NCG4 · ZAC4V5NCG4
Chemistry & industry
Applications
UsesN,N,N'',N''-Tetrabutyl-1,3-propanediamine is used as a reagent in the synthesis of 3-[(N,N-dialkylamino)alkyl]-6-halo-2-phenyl-3,4-dihydroquinazolin-4(3H)-ones as antihistaminic agents. Also used as an insecticide.
Suppliers7 total
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
孟成科技（上海）有限公司400-820-6829 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
广州市桐晖药业有限公司020-66392521-118 18922260391 · [email protected]
南京宁吉通医药生物科技有限公司0-19710401727 19710401727 · [email protected]
江西叶宏医药科技有限公司0793-15967982-804 13970348580 · [email protected]
广州市震霖医药科技有限公司020-18102736 13622807357 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…