Basic information
- CAS
770-65-0- Standard SMILES
CCC(O)(CN)c1ccccc1- InChIKey
ULFJMPCWXPSJQL-UHFFFAOYSA-N- Molecular formula
- C10H15NO
- Average molar mass
- 165.23 g/mol
- Monoisotopic mass
- 165.1153641
Names & identifiers
- Preferred name
- 1-Amino-2-phenylbutan-2-ol
- IUPAC
- 1-amino-2-phenylbutan-2-ol
- English name
- 1-Amino-2-phenylbutan-2-ol
- Molecular formula
- C10H15NO
- Molecular weight
- 165.24
Names & synonyms
1-amino-2-phenylbutan-2-ol770-65-0DTXSID70274599RefChem:227504DTXCID20226068MFCD119345291-amino-2-phenyl-butan-2-olNSC30434Alpha-aminomethyl-alpha-ethylbenzyl alcoholF2189-0884SCHEMBL12926341-Amino-2-phenyl-2-butanol #
Show more names
Benzenemethanol, α-(aminomethyl)-α-ethyl-
ULFJMPCWXPSJQL-UHFFFAOYSA-NNSC-30434AKOS012067635AB91391CS-0296012EN300-234847F80322F686073
Database identifiers
- CAS
770-65-0- PubChem CID
- 17831
- DTXSID
DTXSID70274599- Nikkaji
- J1.405.920B
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- Melting point
- 180 · 180-181 °C
- Boiling point
- 137 · 137-146 °C(Press: 15 Torr)
- Density
- 1.0404 g/cm3 · 1.0404 g/cm3(Temp: 19.5 °C)
- storage temp.
- Store at Room Tem.
- pka
- 12.11 · 12.11±0.50(Predicted)
- Appearance
- white solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 303 · H303-H320
- Precautionary statements
- 312 · P312-P264-P305+P351+P338-P337+P313
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H303-H320
- Precautionary statements
- P312-P264-P305+P351+P338-P337+P313
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers2 total
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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