2,4,5-T isopropanolamine salt
Basic information
- CAS
1319-72-8- Standard SMILES
CC(O)CN.O=C(O)COc1cc(Cl)c(Cl)cc1Cl- InChIKey
WLTODFLUDPNNBX-UHFFFAOYSA-N- Molecular formula
- C11H14Cl3NO4
- Average molar mass
- 330.6 g/mol
- Monoisotopic mass
- 328.998841
Names & identifiers
- Preferred name
- 2,4,5-T isopropanolamine salt
- IUPAC
- 1-aminopropan-2-ol;2-(2,4,5-trichlorophenoxy)acetic acid
- English name
- 1-aminopropan-2-ol: 2-(2,4,5-trichlorophenoxy)acetic acid
- Molecular formula
- C11H14Cl3NO4
- Molecular weight
- 330.59
Names & synonyms
2,4,5-T isopropanolamine salt1319-72-81-aminopropan-2-ol;2-(2,4,5-trichlorophenoxy)acetic acid1-aminopropan-2-ol: 2-(2,4,5-trichlorophenoxy)acetic acidDTXSID00927384Acetic acid, (2,4,5-trichlorophenoxy)-, compound with 1-amino-2-propanol (1:1)(2,4,5-Trichlorophenoxy)acetic acid--1-aminopropan-2-ol (1/1)2,4,5-T AminesAcetic acid, (2,4,5-trichlorophenoxy)-, compd. with 1-amino-2-propanol (1:1)(2,4,5-TRICHLOROPHENOXY)ACETIC ACID, COMPOUND WITH 1-AMINO-2-PROPANOL (1:1))
Database identifiers
- CAS
1319-72-8- PubChem CID
- 62398
- DTXSID
DTXSID00927384
Properties
Computed structural properties
- Topological polar surface area
- 92.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 235
Physicochemical properties
- EPA Substance Registry System
- 2 · 2,4,5-T isopropanolamine salt (1319-72-8)
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Compound notes
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