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2,5-Dimethylbenzaldehyde 95%

CAT: 0286-D37408-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0286-D37408-01Size:5 g
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CAS Number
5779-94-2
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00003342
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

2,5-Dimethylbenzaldehyde

2,5-Dimethylbenzaldehyde is a carbonyl compound.

CAS Number5779-94-2
PubChem CID22015
IUPAC Name2,5-dimethylbenzaldehyde
Molecular FormulaC9H10O
Molecular Weight134.17
XLogP2.1
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity120
SMILES
CC1=CC(=C(C=C1)C)C=O
InChI
InChI=1S/C9H10O/c1-7-3-4-8(2)9(5-7)6-10/h3-6H,1-2H3
InChIKey
SMUVABOERCFKRW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-Dimethylbenzaldehyde
CAS: 5779-94-2
CID: 22015
Formula: C9H10O
MW: 134.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight134.17
XLogP32.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass134.073164938
Monoisotopic Mass134.073164938
Topological Polar Surface Area17.1 Ų
Heavy Atom Count10
Formal Charge0
Complexity120
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
FD61423-012,5-Dimethylbenzaldehyde
EEC96030-012- (Difluoromethoxy) -4,5-dimethylbenzaldehyde
284487-012-Methoxy-3,5-dimethylbenzaldehyde
OR1083854-014- (Benzyloxy) -2,5-dimethylbenzaldehyde
PC1012723-012-fluoro-3,5-dimethylbenzaldehyde
PC10127222-fluoro-4,5-dimethylbenzaldehyde
OR1097276-012-Benzyloxy-4,5-dimethylbenzaldehyde
LDA58231-012-Methoxy-4,5-dimethylbenzaldehyde
JH1693232-hydroxy-4,5-dimethylbenzaldehyde
OR10946172- (Cyclopropylmethoxy) -3,5-dimethylbenzaldehyde

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