O-Nitrophenol

CAT: 0286-N10440-03Size: 5000 gDry Ice: NoHazardous: Yes

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CAT#:0286-N10440-03Size:5000 g

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CAS Number

88-75-5

UN Code

UN1663

Pictogram

07 - Irritant

UDF Signal Word

Warning

MDL Number

MFCD00011688

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; H402 Harmful to aquatic life.

DOT Name

Nitrophenols

DOT Classification

Class 6.1

Packaging Group

PGIII

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-Nitrophenol

2-nitrophenol is a member of the class of 2-nitrophenols that is phenol in which one of the hydrogens that is ortho to the hydroxy group has been replaced by a nitro group. It is a conjugate acid of a 2-nitrophenolate.

CAS Number	88-75-5
PubChem CID	6947
IUPAC Name	2-nitrophenol
Molecular Formula	C6H5NO3
Molecular Weight	139.11
XLogP	1.8
Topological Polar Surface Area	66.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	131

SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])O

InChI

InChI=1S/C6H5NO3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H

InChIKey

IQUPABOKLQSFBK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 88-75-5

CID: 6947

Formula: C6H5NO3

MW: 139.11

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	139.11
XLogP3	1.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	139.026943022
Monoisotopic Mass	139.026943022
Topological Polar Surface Area	66.1 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	131
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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O-Nitrophenol

Chemical Information

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