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3 4-Difluorotoluene

CAT: 0286-D25845Size: 5 gDry Ice: NoHazardous: No
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CAT#:0286-D25845Size:5 g
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CAS Number
2927-34-6
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00075087
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H320 Causes eye irritation; H332 Harmful if inhaled.
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-Difluorotoluene
CAS Number2927-34-6
PubChem CID2733400
IUPAC Name1,2-difluoro-4-methylbenzene
Molecular FormulaC7H6F2
Molecular Weight128.12
XLogP2.5
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity92
SMILES
CC1=CC(=C(C=C1)F)F
InChI
InChI=1S/C7H6F2/c1-5-2-3-6(8)7(9)4-5/h2-4H,1H3
InChIKey
FZMPLKVGINKUJZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,4-Difluorotoluene
CAS: 2927-34-6
CID: 2733400
Formula: C7H6F2
MW: 128.12
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight128.12
XLogP32.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass128.04375652
Monoisotopic Mass128.04375652
Topological Polar Surface Area0 Ų
Heavy Atom Count9
Formal Charge0
Complexity92.9
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