DDT
Properties
- Molecular formula
- C14H9Cl5
- Molar mass
- 354.48 g/mol
- Exact mass
- 351.9147 Da
- Density
- 0.98–0.99 g/mL
- Melting point
- 108.5 °C
- Boiling point
- 260 °C
- Water solubility
- < 1 g/L (21.1 °C)
- logP
- 6.50Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 2
Hazards
Danger
- H301 Toxic if swallowedAcute toxicity, oral
- H351 Suspected of causing cancerCarcinogenicity
- H372 ** Causes damage to organs through prolonged or repeated exposureSpecific target organ toxicity, repeated exposure
- H400 Very toxic to aquatic lifeHazardous to the aquatic environment, acute hazard
- H410 Very toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard
Harmonised EU classification (CLP Annex VI, index 602-045-00-7), via PubChem.
Precautionary statements
P203, P260, P264, P270, P273, P280, P301+P316, P318, P319, P321, P330, P391, P405, P501
Identifiers
CAS number
50-29-3SMILES
Clc1ccc(C(c2ccc(Cl)cc2)C(Cl)(Cl)Cl)cc1InChIKey
YVGGHNCTFXOJCH-UHFFFAOYSA-NInChI
InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
66 names · show all
- Benzene, 1,1′-(2,2,2-trichloroethylidene)bis[4-chloro-
- Ethane, 1,1,1-trichloro-2,2-bis(p-chlorophenyl)-
- 1,1′-(2,2,2-Trichloroethylidene)bis[4-chlorobenzene]
- Arkotine
- α,α-Bis(p-chlorophenyl)-β,β,β-trichlorethane
- 2,2-Bis(p-chlorophenyl)-1,1,1-trichloroethane
- Chlorophenothane
- p,p′-DDT
- 4,4′-Dichlorodiphenyltrichloroethane
- Dicophane
- p,p′-Dichlorodiphenyltrichloroethane
- Estonate
- Gesafid
- Gesarol
- Neocid
- Pentachlorin
- Trichlorobis(4′-chlorophenyl)ethane
- 1,1,1-Trichloro-2,2-bis(p-chlorophenyl)ethane
- Zerdane
- Agritan
- Azotox M 33
- Citox
- 4,4′-DDT
- Dykol
- Clofenotan
- ENT-1506
- Ethane, 1,1,1-trichloro-2,2-bis(4-chlorophenyl)-
- 1,1-Bis(p-chlorophenyl)-2,2,2-trichloroethane
- Detoxan
- Clofenotane
- Aavero-extra
- Chlorphenothan
- Deoval
- Mutoxan
- PEB1
- Penticidum
- Dodat
- Bosan supra
- Bovidermol
- Ivoran
- Chlorphenotoxum
- Parachlorocidum
- Dibovin
- Neocidol (solid)
- Tafidex
- 2,2,2-Trichloro-1,1-bis(4-chlorophenyl)ethane
- p,p′-Dichlorodiphenyltrichloromethylmethane
- Neocidol
- 1,1-Bis(4-chlorophenyl)-2,2,2-trichloroethane
- Hildit
- Benzochloryl
- 1,1,1-Trichloro-2,2-di(p-chlorophenyl)ethane
- Detox (pesticide)
- Gesarex
- Gesapon
- Guesapon
- Dicophaner
- NSC 8939
- o,p′-1,1,1-Trichloro-2-2,2-bis(p-chlorophenyl)ethane
- FWJ
- Dichlorodiphenyltrichloroethane
- 1,1,1-Trichloro-2-2,2-bis(p-chlorophenyl)ethane
- 2,2-Bis(4-chlorophenyl)-1,1,1-trichloroethane
- Detox
- para-Para DDT
- 1-Chloro-4-(2,2,2-trichloro-1-(4-chlorophenyl)ethyl)benzene
Work with DDT
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Methoxychlor72-43-552 % similar
P,P'-Ddd72-54-850 % similar
4-Chlorobenzhydryl chloride134-83-846 % similar
4,4′-Dichlorobenzhydrol90-97-146 % similar
1,4-Dichlorobenzene106-46-745 % similar
4-Chlorobenzotrichloride5216-25-142 % similar
2-(4-Chlorophenyl)-1,3-dioxolane2403-54-541 % similar
(+)-1-(4-Chlorophenyl)ethylamine27298-99-341 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.