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TCA ammonium salt

HCID 24289
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Basic information

CAS
7646-88-0
Standard SMILES
O=C([O-])C(Cl)(Cl)Cl.[NH4+]
InChIKey
MHMUIIBVMBOAON-UHFFFAOYSA-N
Molecular formula
C2H4Cl3NO2
Average molar mass
180.41 g/mol
Monoisotopic mass
178.930761

Names & identifiers

Preferred name
TCA ammonium salt
IUPAC
azanium 2,2,2-trichloroacetate
English name
ammonium trichloroacetate
Molecular formula
C2HCl3O2.H3N
Molecular weight
180.42

Names & synonyms

AMMONIUM TRICHLOROACETATE7646-88-07PL9R555XTDTXSID80897273TCA ammonium saltRefChem:1099410DTXCID601326657231-593-6TCA-ammoniumTCA-ammonium [ISO]azanium;2,2,2-trichloroacetateAmmonium 2,2,2-trichloroacetate
Show more names
Trichloroacetic acid ammonium salt
Caswell No. 049UNII-7PL9R555XTEINECS 231-593-6EPA Pesticide Chemical Code 076801Acetic acid, trichloro-, ammonium saltTCA AMMONIUMNS00081807ACETIC ACID, 2,2,2-TRICHLORO-, AMMONIUM SALT (1:1)

Database identifiers

CAS
7646-88-0
PubChem CID
24289
DTXSID
DTXSID80897273
UNII
7PL9R555XT
EC Number
231-593-6

Properties

Computed structural properties

Topological polar surface area
41.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
8
Formal charge
0
Complexity
77.9

Physicochemical properties

Cosmetics Ingredients Functions
EXFOLIATING
FDA UNII
7 PL9R555XT · 7PL9R555XT
EPA Substance Registry System
Ammonium trichloroacetate (7646-88-0)

Related reactions

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Compound notes

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