Basic information
- CAS
16486-74-1- Standard SMILES
CCCCNC(C)(C)C- InChIKey
VACPZDQXUAOTFR-UHFFFAOYSA-N- Molecular formula
- C8H19N
- Average molar mass
- 129.24 g/mol
- Monoisotopic mass
- 129.15174961
Names & identifiers
- Preferred name
- N-(1,1-Dimethylethyl)-1-butanamine
- IUPAC
- N-tert-butylbutan-1-amine
- English name
- N-tert-butylbutylamine
- Molecular formula
- C8H19N
- Molecular weight
- 129.24
Names & synonyms
N-tert-Butylbutylamine16486-74-1N-(1,1-Dimethylethyl)-1-butanamineDTXSID30167812RefChem:1090741DTXCID3090303240-543-2N-tert-butylbutan-1-amineN-Butyl-tert-butylamine1-Butanamine, N-(1,1-dimethylethyl)-EINECS 240-543-2BUTYL(TERT-BUTYL)AMINE
Show more names
tert-Butylbutylamine
t-butylaminobutanet-butyl-n-butylamineButyl-tert-butylaminetert-Butyl-n-butyl-amineN-tert-Butyl-n-butylamine5A7A4VX8RRN-(tert-Butyl)-1-butanamineSCHEMBL269107
Database identifiers
- CAS
16486-74-1- PubChem CID
- 85447
- DTXSID
DTXSID30167812- UNII
- 5A7A4VX8RR
- EC Number
- 240-543-2
- Nikkaji
- J318.211H
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 61.5
Physicochemical properties
- Boiling point
- 115 · 115-117 °C(Press: 750 Torr)
- Density
- 0.762 · 0.762±0.06 g/cm3(Predicted)
- pka
- 10.84 · 10.84±0.38(Predicted)
Chemistry & industry
Suppliers2 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
1 records
Compound notes
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