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P-Bromoethylbenzene 97%

CAT: 0286-B20955-01Size: 10 gDry Ice: NoHazardous: No
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CAT#:0286-B20955-01Size:10 g
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CAS Number
1585-07-5
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00000111
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H320 Causes 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

1-Bromo-4-ethylbenzene
CAS Number1585-07-5
PubChem CID15313
IUPAC Name1-bromo-4-ethylbenzene
Molecular FormulaC8H9Br
Molecular Weight185.06
XLogP3.6
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity72
SMILES
CCC1=CC=C(C=C1)Br
InChI
InChI=1S/C8H9Br/c1-2-7-3-5-8(9)6-4-7/h3-6H,2H2,1H3
InChIKey
URFPRAHGGBYNPW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Bromo-4-ethylbenzene
CAS: 1585-07-5
CID: 15313
Formula: C8H9Br
MW: 185.06
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight185.06
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass183.98876
Monoisotopic Mass183.98876
Topological Polar Surface Area0 Ų
Heavy Atom Count9
Formal Charge0
Complexity72.6
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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