p-Aminopropiophenone hydrochloride
Basic information
- CAS
6170-25-8- Standard SMILES
CCC(=O)c1ccc(N)cc1.Cl- InChIKey
VDAXOIZQZPYAOM-UHFFFAOYSA-N- Molecular formula
- C9H12ClNO
- Average molar mass
- 185.65 g/mol
- Monoisotopic mass
- 185.0607417
Names & identifiers
- Preferred name
- p-Aminopropiophenone hydrochloride
- IUPAC
- 1-(4-aminophenyl)propan-1-one;hydrochloride
- English name
- para-Aminopropiophenonehydrochloride
- Molecular weight
- 0
Names & synonyms
p-Aminopropiophenone hydrochloride6170-25-88DHL7HY90IUNII-8DHL7HY90IPropiophenone, 4'-amino-, hydrochlorideP-AMINOPROPIOPHENONE HYDROCHLORIDE [MI]1-PROPANONE, 1-(4-AMINOPHENYL)-, HYDROCHLORIDE (1:1)RefChem:1692791-(4-aminophenyl)propan-1-one hydrochloride1-(4-aminophenyl)propan-1-one;hydrochlorideDTXSID30977276AKOS037875194
Show more names
para-Aminopropiophenonehydrochloride
1-(4-aminophenyl)propan-1-onehydrochlorideQ272702281-(4-Aminophenyl)propan-1-one--hydrogen chloride (1/1)
Database identifiers
- CAS
6170-25-8- PubChem CID
- 80310
- DTXSID
DTXSID30977276- UNII
- 8DHL7HY90I
Properties
Computed structural properties
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 136
Physicochemical properties
- Melting point
- 198 · 198-199°
- FDA UNII
- 8 DHL7HY90I · 8DHL7HY90I
- RIDADR
- 2811 · 2811
- HazardClass
- 6.1 · 6.1(b)
- PackingGroup
- III
- Toxicity
- 50 i.v · LD50 i.v. in dogs: 7.15 ±0.89 mg/kg (Rose)
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
- ridadr
- 2811
- Toxicity
- LD50 i.v. in dogs: 7.15 ±0.89 mg/kg (Rose)
- hazard_class
- 6.1(b)
- packing_group
- III
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Compound notes
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