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M-Ethoxybenzoyl chloride

CAT: 0286-E03246-01Size: 50 mgDry Ice: NoHazardous: Yes
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CAT#:0286-E03246-01Size:50 mg
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CAS Number
61956-65-8
UN Code
UN3261
Pictogram
05 - Corrosive; 07 - Irritant
UDF Signal Word
Danger
MDL Number
MFCD00000677
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H314 Causes severe skin burns and eye damage; H318 Causes serious eye damage; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Corrosive Solid, Acidic, Organic, N.O.S.
DOT Classification
Class 8
Packaging Group
PGII
Precautions
P260 Do not breathe dust/fume/gas/mist/vapors/spray; P264 Wash skin thoroughly after handling; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P330+P331 IF SWALLOWED: Rinse mouth. Do NOT induce vomiting; P302+P352 IF ON SKIN: wash with plenty of soap and water; P303+P361+P353 IF ON SKIN (or hair) : Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

3-ethoxybenzoyl Chloride
CAS Number61956-65-8
PubChem CID2769417
IUPAC Name3-ethoxybenzoyl chloride
Molecular FormulaC9H9ClO2
Molecular Weight184.62
XLogP3.4
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity159
SMILES
CCOC1=CC=CC(=C1)C(=O)Cl
InChI
InChI=1S/C9H9ClO2/c1-2-12-8-5-3-4-7(6-8)9(10)11/h3-6H,2H2,1H3
InChIKey
GDBMWSHYPYKDED-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-ethoxybenzoyl Chloride
CAS: 61956-65-8
CID: 2769417
Formula: C9H9ClO2
MW: 184.62
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight184.62
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass184.0291072
Monoisotopic Mass184.0291072
Topological Polar Surface Area26.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity159
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
sc-2302592-Ethoxybenzoyl chloride
OR1003723-013-Ethoxybenzoyl chloride
OR480584-014-Ethoxybenzoyl chloride
FE36831-01O-Ethoxybenzoyl chloride
sc-3368535-chloro-2-ethoxybenzoyl chloride
sc-3361414- (cyclopentyloxy) -3-ethoxybenzoyl chloride
sc-3368195-bromo-2-ethoxybenzoyl chloride
sc-3361324- (benzyloxy) -3-ethoxybenzoyl chloride
sc-3230134-butoxy-3-ethoxybenzoyl chloride
sc-3361894-[ (2-chlorobenzyl) oxy]-3-ethoxybenzoyl chloride

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