2,3-Dichlorobenzeneethanol

CAT: 0127-OR918460-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR918460-01Size:250 mg

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CAS Number

114686-85-0

MDL Number

MFCD04112742

Purity

98%

Smiles

OCCc1cccc(Cl)c1Cl

Chemical Information

2-(2,3-Dichlorophenyl)ethan-1-ol

CAS Number	114686-85-0
PubChem CID	2734759
IUPAC Name	2-(2,3-dichlorophenyl)ethanol
Molecular Formula	C8H8Cl2O
Molecular Weight	191.05
XLogP	2.8
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	119

SMILES

C1=CC(=C(C(=C1)Cl)Cl)CCO

InChI

InChI=1S/C8H8Cl2O/c9-7-3-1-2-6(4-5-11)8(7)10/h1-3,11H,4-5H2

InChIKey

FJJDHDLMGJKZKV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 114686-85-0

CID: 2734759

Formula: C8H8Cl2O

MW: 191.05

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	191.05
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	189.9952203
Monoisotopic Mass	189.9952203
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	119
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
PC450310	2,2,3,3,3-Pentafluoropropyl 2,2,3,3-tetrafluoropropyl carbonate
PC5605	2,2,3,3,3-Pentafluoropropiophenone
PC5786	2,2,3,3,3-Pentafluoropropylamine
PC450297	2,2,3,3,3-Pentafluoropropyl 2,2,2-trifluoroethyl carbonate
PC3683-01	2- (2,2,3,3,3-Pentafluoropropoxymethyl) oxirane
PC4969	2,2,3,3,3-Pentafluoropropyl-2'-fluoroacrylate
PC31768-01	2,3,3,3-Tetrafluoro-2- (1,1,2,2,3,3,3-heptafluoropropoxy) propanamide
PC450298	2,2-Difluoroethyl 2,2,3,3,3-pentafluoropropyl carbonate
PC250031-01	2,2,2-Trifluoroethyl 3,3,3-trifluoro-2-methylpropanoate
OR1005177	2,2,3,3-Tetramethylsuccinonitrile

Catalog	Name
009140	3,4-Dichlorobenzeneethanol
sc-260169	2,2,3,3,3-Pentafluoropropylamine
sc-321959A	2,2,3,3,3-Pentafluoropropyltrifluoromethanesulfonate
sc-260168	2,2,3,3,3-Pentafluoropropiophenone
FT66102-01	2,2',3,3'-Tetramethylazoxybenzene
RG-P022709-01	2,2,3,3-Tetramethylsuccinimidamide
sc-473699	2,2,3,3-Tetramethylsuccinimide
sc-356534A	2,2,3,3-Tetrafluoropropionamide
GTR19188374-01	2,3,2'',3''-Tetrahydroochnaflavone
GTR19254282-01	2,2,3,3-Tetrafluorobenzodioxene