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3- (p-Chlorophenoxy) propionic acid 97%

CAT: 0286-C16972-01Size: 5 gDry Ice: NoHazardous: No
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CAS Number
3284-79-5
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00043504
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; 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-(4-Chlorophenoxy)propionic acid
CAS Number3284-79-5
PubChem CID76780
IUPAC Name3-(4-chlorophenoxy)propanoic acid
Molecular FormulaC9H9ClO3
Molecular Weight200.62
XLogP2
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count13
Formal Charge0
Complexity164
SMILES
C1=CC(=CC=C1OCCC(=O)O)Cl
InChI
InChI=1S/C9H9ClO3/c10-7-1-3-8(4-2-7)13-6-5-9(11)12/h1-4H,5-6H2,(H,11,12)
InChIKey
OWHJDUCBLVMRBJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(4-Chlorophenoxy)propionic acid
CAS: 3284-79-5
CID: 76780
Formula: C9H9ClO3
MW: 200.62
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight200.62
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass200.0240218
Monoisotopic Mass200.0240218
Topological Polar Surface Area46.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity164
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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GTR19252220-013- (P-chlorophenoxy) propionic acid
413416-012- (3-Chlorophenoxy) propionic acid
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