Benzeneacetic acid, ammonium salt (1:1)
Basic information
- CAS
7188-16-1- Standard SMILES
O=C([O-])Cc1ccccc1.[NH4+]- InChIKey
PQILKFQDIYPBKI-UHFFFAOYSA-N- Molecular formula
- C8H11NO2
- Average molar mass
- 153.18 g/mol
- Monoisotopic mass
- 153.07897859
Names & identifiers
- Preferred name
- Benzeneacetic acid, ammonium salt (1:1)
- IUPAC
- azanium 2-phenylacetate
- English name
- ammonium phenyl acetate
- Molecular formula
- C8H11NO2
- Molecular weight
- 153.17844
Names & synonyms
Benzeneacetic acid, ammonium salt7188-16-1DTXSID1064588EINECS 230-551-4Benzeneacetic acid, ammonium salt (1:1)RefChem:117377DTXCID1047150ammonium phenylacetateazanium;2-phenylacetateAmmonium 2-phenylacetateAmmonium phenyl acetateAmmoniumphenylacetat
Show more names
benzenemacetic acid,salt(1：1)Phenylacetic acid ammonium saltBenzeneacetic acid,ammonium salt
PX9XBC6PGQAKOS028109664
Database identifiers
- CAS
7188-16-1- PubChem CID
- 81607
- DTXSID
DTXSID1064588- UNII
- PX9XBC6PGQ
- EC Number
- 230-551-4
Properties
Computed structural properties
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 109
Physicochemical properties
- EPA Substance Registry System
- Benzeneacetic acid, ammonium salt (7188-16-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzeneacetic acid, ammonium salt (1:1): ACTIVE
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Related reactions
1 records
Compound notes
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