P-Fluorocinnamic acid 98%

CAT: 0286-F03015-02Size: 25 gDry Ice: NoHazardous: No

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CAT#:0286-F03015-02Size:25 g

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CAS Number

459-32-5

Pictogram

07 - Irritant

UDF Signal Word

Warning

MDL Number

MFCD00004395

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.

DOT Name

Not D.O.T.-Regulated

Precautions

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-Fluorophenyl)-2-propenoic acid

CAS Number	459-32-5
PubChem CID	98070
IUPAC Name	3-(4-fluorophenyl)prop-2-enoic acid
Molecular Formula	C9H7FO2
Molecular Weight	166.15
XLogP	1.9
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	181

SMILES

C1=CC(=CC=C1C=CC(=O)O)F

InChI

InChI=1S/C9H7FO2/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6H,(H,11,12)

InChIKey

ISMMYAZSUSYVQG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 459-32-5

CID: 98070

Formula: C9H7FO2

MW: 166.15

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	166.15
XLogP3	1.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	166.04300762
Monoisotopic Mass	166.04300762
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	181
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	1
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
sc-233771	α-Fluorocinnamic acid
FF30854-01	4-Fluorocinnamic acid
276714-01	3-Fluorocinnamic acid
T21182-01	M-Fluorocinnamic acid
276720	2-Fluorocinnamic acid
sc-229505	Trans-3-Fluorocinnamic acid
TEA40966-01	α-Cyano-4-fluorocinnamic acid
FC67942	4-Chloro-2-fluorocinnamic acid
430986-01	4-Bromo-3-fluorocinnamic acid
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P-Fluorocinnamic acid 98%

Chemical Information

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