a,a-Difluoro-benzeneacetyl Chloride - CAS 312-24-3
Catalog: |
BB073938 |
Product Name: |
a,a-Difluoro-benzeneacetyl Chloride |
CAS: |
312-24-3 |
Synonyms: |
2,2-difluoro-2-phenylacetyl chloride; PhCF2COCl; 2,2-difluoro-2-phenylacetylchloride; Benzeneacetyl chloride, a,a-difluoro- |
IUPAC Name: | 2,2-difluoro-2-phenylacetyl chloride |
Molecular Weight: | 190.57 |
Molecular Formula: | C8H5OF2Cl |
Canonical SMILES: | C1=CC=C(C=C1)C(C(=O)Cl)(F)F |
InChI: | InChI=1S/C8H5ClF2O/c9-7(12)8(10,11)6-4-2-1-3-5-6/h1-5H |
InChI Key: | WHESXQIOHUXMOJ-UHFFFAOYSA-N |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 |
Signal Word: | Danger |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.9996988 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.9996988 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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