M-Nitrophenol Indicator 99% AR

CAT: 1278-01862 00005Size: 5 gDry Ice: NoHazardous: No

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CAT#:1278-01862 00005Size:5 g

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CAS Number

554-84-7

HS Code

29089990

Packaging Group

Chemical Information

3-Nitrophenol

3-nitrophenol is a member of the class of 3-nitrophenols that is phenol in which one of the hydrogens that is meta to the hydroxy group has been replaced by a nitro group.

CAS Number	554-84-7
PubChem CID	11137
IUPAC Name	3-nitrophenol
Molecular Formula	C6H5NO3
Molecular Weight	139.11
XLogP	2
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(=CC(=C1)O)[N+](=O)[O-]

InChI

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

InChIKey

RTZZCYNQPHTPPL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 554-84-7

CID: 11137

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	2
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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