3-(Trityl-amino)-propionic acid
Basic information
- CAS
58995-30-5- Standard SMILES
O=C(O)CCNC(c1ccccc1)(c1ccccc1)c1ccccc1- InChIKey
DRBJRRIAZMJBOC-UHFFFAOYSA-N- Molecular formula
- C22H21NO2
- Average molar mass
- 331.4 g/mol
- Monoisotopic mass
- 331.15722891
Names & identifiers
- Preferred name
- 3-(Trityl-amino)-propionic acid
- IUPAC
- 3-(tritylamino)propanoic acid
- English name
- 3-[(triphenylmethyl)amino]propanoic acid
- Molecular formula
- C22H21NO2
- Molecular weight
- 331.41
Names & synonyms
3-(TRITYL-AMINO)-PROPIONIC ACIDRefChem:496483653-222-03-(tritylamino)propanoic Acid58995-30-53-(tritylamino)propionic acidSCHEMBL4211757DTXSID70408716N-(Triphenylmethyl)-beta-alanineDRBJRRIAZMJBOC-UHFFFAOYSA-NAKOS024334042β-Alanine, N-(triphenylmethyl)-
Show more names
3-[(triphenylmethyl)amino]propanoic acid
Database identifiers
- CAS
58995-30-5- PubChem CID
- 5141817
- DTXSID
DTXSID70408716- EC Number
- 653-222-0
- Nikkaji
- J2.383.217H
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 359
Physicochemical properties
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 315 · H315-H318-H335-H301
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P310-P321-P330-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06
- Hazard statements
- H315-H318-H335-H301
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P310-P321-P330-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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