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Basic information
- CAS
35695-70-6- Standard SMILES
NCC(O)C(Cl)(Cl)Cl- InChIKey
PUFKULWKRHGOIL-UHFFFAOYSA-N- Molecular formula
- C3H6Cl3NO
- Average molar mass
- 178.44 g/mol
- Monoisotopic mass
- 176.951497
Names & identifiers
- Preferred name
- Propanol, 3-amino-1-trichloro-
- IUPAC
- 3-amino-1,1,1-trichloropropan-2-ol
Names & synonyms
35695-70-6Propanol, 3-amino-1-trichloro-RefChem:10968983-amino-1,1,1-trichloropropan-2-olTCA-PRBRN 17378093-Amino-1-trichloro-2-propanol2-Propanol, 3-amino-1,1,1-trichloro-SCHEMBL11243487SCHEMBL11243500DTXSID30957093PUFKULWKRHGOIL-UHFFFAOYSA-N
Show more names
2-hydroxy-3,3,3-trichloro-propylamine3-04-00-00764 (Beilstein Handbook Reference)
Database identifiers
- CAS
35695-70-6- PubChem CID
- 215437
- DTXSID
DTXSID30957093- Nikkaji
- J90.390F
Properties
Computed structural propertiesFilling in
- XLogP
- 0.5
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 71
Related reactions
1 records
Compound notes
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