4-[ (1R) -1-Hydroxyethyl]Phenol

CAT: 0127-OR1022916-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1022916-01Size:100 mg

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CAS Number

129830-97-3

Synonyms

4-[ (1R) -1-hydroxyethyl]phenol

Purity

98%

Smiles

C[C@H](C1=CC=C(C=C1)O)O

Chemical Information

4-[(1R)-1-hydroxyethyl]phenol

CAS Number	129830-97-3
PubChem CID	12576674
IUPAC Name	4-[(1R)-1-hydroxyethyl]phenol
Molecular Formula	C8H10O2
Molecular Weight	138.16
XLogP	0.2
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	95

SMILES

C[C@H](C1=CC=C(C=C1)O)O

InChI

InChI=1S/C8H10O2/c1-6(9)7-2-4-8(10)5-3-7/h2-6,9-10H,1H3/t6-/m1/s1

InChIKey

PMRFBLQVGJNGLU-ZCFIWIBFSA-N

Chemical Structure

2D Structure

CAS: 129830-97-3

CID: 12576674

Formula: C8H10O2

MW: 138.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	138.16
XLogP3	0.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	138.068079557
Monoisotopic Mass	138.068079557
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	95.4
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
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
OR96706-01	4- (1-Hydroxyethyl) phenol
OR48265	4-[ (1R) -1-Aminoethyl]phenol
OR2934-01	4- (2-Hydroxyethyl) phenol
OR1052214	2- (1-Hydroxyethyl) phenol
IN12826	(1R) -1- (Diphenylphosphino) -2-[ (1R) -1-hydroxyethyl]ferrocene
OR1069238-01	4- (1-Amino-2-hydroxyethyl) phenol hydrochloride
OR1041138-01	Tert-Butyl 4-[ (1R) -1-hydroxyethyl]piperidine-1-carboxylate
OR1059410-01	(R) -3- (1-Hydroxyethyl) phenol
OR85949	(R) -4- (1-Amino-2-hydroxyethyl) phenol hydrochloride
OR1058409-01	(S) -4- (1-Amino-2-hydroxyethyl) phenol hydrochloride

Catalog	Name
EFA83097-01	4-[ (1R) -1-Hydroxyethyl]phenol
AAB85210-01	3-[ (1R) -1-Hydroxyethyl]phenol
SMA82969-01	3-[ (1R) -1-Hydroxyethyl]benzonitrile
HCD41635-01	4-[ (1R) -1-Hydroxyethyl]-2-nitrophenol
EFA44647-01	Methyl 4-[ (1R) -1-hydroxyethyl]benzoate
XEC45241-01	3-[ (1R) -1-Hydroxyethyl]benzene-1-sulfonamide
VIA94821-01	4-[ (1R) -1-Hydroxyethyl]benzene-1-sulfonamide
YEA98275	2-[ (1R) -1-Aminoethyl]phenol hydrochloride
AR-P29722-01	3-[ (1R) -1- (Dimethylamino) ethyl]phenol
SMC88073-01	3-[ (1R) -2-Amino-1-hydroxyethyl]benzonitrile