2-Chloro-4- (2-hydroxyethyl) phenol

CAT: 0926-ACA97263-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-ACA97263-01Size:100 mg

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CAS Number

50972-63-9

MDL Number

MFCD00033226

Smiles

C1=CC (=C (C=C1CCO) Cl) O

Molecular Formula

C8H9ClO2

Molecular Weight

172.61 g/mol

Controlled

Chemical Information

2-Chloro-4-(2-hydroxyethyl)phenol

2-chloro-4-(2-hydroxyethyl)phenol has been reported in Leptoxyphium fumago with data available.

CAS Number	50972-63-9
PubChem CID	10419647
IUPAC Name	2-chloro-4-(2-hydroxyethyl)phenol
Molecular Formula	C8H9ClO2
Molecular Weight	172.61
XLogP	1.1
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	119

SMILES

C1=CC(=C(C=C1CCO)Cl)O

InChI

InChI=1S/C8H9ClO2/c9-7-5-6(3-4-10)1-2-8(7)11/h1-2,5,10-11H,3-4H2

InChIKey

ZGAMFWSQAUCSGB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 50972-63-9

CID: 10419647

Formula: C8H9ClO2

MW: 172.61

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	172.61
XLogP3	1.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	172.0291072
Monoisotopic Mass	172.0291072
Topological Polar Surface Area	40.5 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
JCD63142-01	3-Chloro-5- (2-hydroxyethyl) phenol
YHA27706-01	4-bromo-2- (2-hydroxyethyl) phenol
FKA73450-01	2-Ethoxy-4- (2-hydroxyethyl) phenol
DMA00905-01	2,6-Dibromo-4- (2-hydroxyethyl) phenol
FH71687-01	4- (1-Hydroxyethyl) phenol
UJB08827-01	4-Chloro-2- (difluoromethoxy) phenol
FC11263	4-Chloro-2-iodo-phenol
FC64432-01	2-Chloro-4- (trifluoromethyl) phenol
CCA07613-01	2-Chloro-4- (2-methoxyethyl) phenol
WFA81269-01	4- (1-Amino-2-hydroxyethyl) phenol hydrochloride

Catalog	Name
AR-P01758-01	4-chloro-3- (2-chloro-1-hydroxyethyl) phenol
OR2934-01	4- (2-Hydroxyethyl) phenol
AR-P01756-01	2-chloro-3- (2-chloro-1-hydroxyethyl) phenol
AR-P01757-01	2-chloro-5- (2-chloro-1-hydroxyethyl) phenol
AR-P01754-01	3- (2-chloro-1-hydroxyethyl) phenol
AR-B01546-01	4- (2-hydroxyethyl) phenol-D4
OR1097830-01	2-Chloro-6- (2,2-dichloro-1-hydroxyethyl) phenol
AL BW 0555-01	4- (2-amino-1-hydroxyethyl) phenol
OR1052214	2- (1-Hydroxyethyl) phenol
AR-P31132-01	2,6-Ditert-butyl-4- (2-hydroxyethyl) Phenol