4-Amino-2,6-dichlorophenol

CAT: 0572-TRC-A632073-5GSize: 5 gDry Ice: NoHazardous: No

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CAT#:0572-TRC-A632073-5GSize:5 g

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CAS Number

5930-28-9

Hazard Statement

No Data Available

Smiles

Nc1cc(Cl)c(O)c(Cl)c1

Molecular Formula

C6H5Cl2NO

Molecular Weight

178.02

Shipping Conditions

Room Temperature

Chemical Information

4-Amino-2,6-dichlorophenol

CAS Number	5930-28-9
PubChem CID	80037
IUPAC Name	4-amino-2,6-dichlorophenol
Molecular Formula	C6H5Cl2NO
Molecular Weight	178.01
XLogP	2.4
Topological Polar Surface Area	46.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	110

SMILES

C1=C(C=C(C(=C1Cl)O)Cl)N

InChI

InChI=1S/C6H5Cl2NO/c7-4-1-3(9)2-5(8)6(4)10/h1-2,10H,9H2

InChIKey

KGEXISHTCZHGFT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5930-28-9

CID: 80037

Formula: C6H5Cl2NO

MW: 178.01

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	178.01
XLogP3	2.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	176.9748192
Monoisotopic Mass	176.9748192
Topological Polar Surface Area	46.3 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	110
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

Catalog	Name
sc-232384	4-Amino-2,6-dichlorophenol
FA70348-01	6-Amino-2,4-dichlorophenol
RG-D090304-01	2-Amino-4,6-Dichlorophenol
901009	4‐AMINO‐2,6‐DICHLOROPHENOL
OR1057366-01	6-Amino-2,3-dichlorophenol
DBA16563-01	3-Amino-2,6-dichlorophenol
OR1004421	2- (((2-Aminoethyl) amino) methyl) -4,6-dichlorophenol
DBA44357	2-Amino-4,5-dichlorophenol
233849-01	5-Amino-2,4-dichlorophenol
sc-479877	4-Amino-2,3-dichlorophenol