2',4'-Dichlorobutyrophenone - CAS 66353-47-7
Catalog: |
BB032999 |
Product Name: |
2',4'-Dichlorobutyrophenone |
CAS: |
66353-47-7 |
Synonyms: |
1-(2,4-dichlorophenyl)-1-butanone; 1-(2,4-dichlorophenyl)butan-1-one |
IUPAC Name: | 1-(2,4-dichlorophenyl)butan-1-one |
Description: | 2',4'-Dichlorobutyrophenone (CAS# 66353-47-7 ) is a useful research chemical. |
Molecular Weight: | 217.09 |
Molecular Formula: | C10H10Cl2O |
Canonical SMILES: | CCCC(=O)C1=C(C=C(C=C1)Cl)Cl |
InChI: | InChI=1S/C10H10Cl2O/c1-2-3-10(13)8-5-4-7(11)6-9(8)12/h4-6H,2-3H2,1H3 |
InChI Key: | FXCJYMLJTUZGDU-UHFFFAOYSA-N |
Boiling Point: | 141 °C / 12 mmHg |
Density: | 1.23 g/cm3 |
Appearance: | Light yellow liquid |
LogP: | 3.97620 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110016000-A | A kind of penconazole raw medicine and preparation method thereof | 20190411 |
EP-2444386-A1 | Process for preparation of norbornene derivatives | 20090619 |
JP-2011001318-A | Method for producing norbornene derivative | 20090619 |
JP-5512174-B2 | Method for producing norbornene derivative | 20090619 |
US-2012108851-A1 | Method for producing norbornene derivative | 20090619 |
Complexity: | 182 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 216.0108703 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 216.0108703 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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