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1-Bromo-2-nitrobenzene 98%

CAT: 0286-B22950-01Size: 25 gDry Ice: NoHazardous: Yes
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CAT#:0286-B22950-01Size:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
577-19-5
UN Code
UN3459
Pictogram
06 - Acute Toxicity; 08 - Health Hazard
UDF Signal Word
Danger
MDL Number
MFCD00007045
Hazard Statement
H301 Toxic if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H331 Toxic if inhaled; H335 May cause respiratory irritation; H373 Causes damage to organs through prolonged or repeated exposure.
DOT Name
Nitrobromobenzene, Solid
DOT Classification
Class 6.1
Packaging Group
PGIII
Precautions
P260 Do not breathe dust/fume/gas/mist/vapors/spray; P264 Wash skin thoroughly after handling; P270 Do not eat, drink, or smoke when using this product; P271 Use only outdoors or in a well-ventilated area; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P310 IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician; 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; P314 Get medical advice/attention if you feel unwell; P332+P313 IF SKIN irritation occurs: Get medical advice/attention; P403+P233 Store in a well-ventilated place. Keep container tightly closed.

Chemical Information

1-Bromo-2-nitrobenzene

structure in first source

CAS Number577-19-5
PubChem CID11341
IUPAC Name1-bromo-2-nitrobenzene
Molecular FormulaC6H4BrNO2
Molecular Weight202.01
XLogP2.5
Topological Polar Surface Area45.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity134
SMILES
C1=CC=C(C(=C1)[N+](=O)[O-])Br
InChI
InChI=1S/C6H4BrNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H
InChIKey
ORPVVAKYSXQCJI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Bromo-2-nitrobenzene
CAS: 577-19-5
CID: 11341
Formula: C6H4BrNO2
MW: 202.01
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight202.01
XLogP32.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass200.94254
Monoisotopic Mass200.94254
Topological Polar Surface Area45.8 Ų
Heavy Atom Count10
Formal Charge0
Complexity134
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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