4- (6-Hydroxyhexyloxy) benzoic acid

CAT: 0024-sc-267132Size: 100 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-267132Size:100 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

83883-25-4

Chemical Information

4-(6-Hydroxyhexyloxy)benzoic acid

CAS Number	83883-25-4
PubChem CID	3628413
IUPAC Name	4-(6-hydroxyhexoxy)benzoic acid
Molecular Formula	C13H18O4
Molecular Weight	238.28
XLogP	3.1
Topological Polar Surface Area	66.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Heavy Atom Count	17
Formal Charge	0
Complexity	209

SMILES

C1=CC(=CC=C1C(=O)O)OCCCCCCO

InChI

InChI=1S/C13H18O4/c14-9-3-1-2-4-10-17-12-7-5-11(6-8-12)13(15)16/h5-8,14H,1-4,9-10H2,(H,15,16)

InChIKey

VVYHWYFUTOHXRH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 83883-25-4

CID: 3628413

Formula: C13H18O4

MW: 238.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	238.28
XLogP3	3.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Exact Mass	238.12050905
Monoisotopic Mass	238.12050905
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	209
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-486887	4- (6-Hydroxyhexyloxy) -4'-methoxybiphenyl
sc-486886	4-Methoxyphenyl 4- (6-Hydroxyhexyloxy) benzoate
sc-315295	4-[ (6-Phenylpyrimidin-4-yl) amino]benzoic acid
sc-314719	4- (4,6-Dimethoxypyrimidin-2-yl) benzoic acid
sc-343525A	2,6-dichloro-4- (trifluoromethyl) benzoic acid
sc-275470	2,6-Dichloro-4- (trifluoromethoxy) benzoic acid
sc-315160	4-[ (2,6-Dichlorobenzyl) oxy]benzoic acid
sc-343525	2,6-dichloro-4- (trifluoromethyl) benzoic acid
sc-483217	2-Amino-4,6-dimethoxy-benzoic acid
sc-347807A	4- (2,6-Dibromo-4-methyl-phenoxymethyl) -benzoic acid

Catalog	Name
OR1011153-01	4- (6-Hydroxyhexyloxy) Benzoic Acid
FB10492-01	2,6-Bistrifluoromethyl benzoic acid
EUB38368-01	2-Methyl-6- (trifluoromethyl) benzoic acid
EKC69857-01	2-Fluoro-6- (phenylsulfanyl) benzoic acid
ISA33072-01	2-Methoxy-6- (trifluoromethoxy) benzoic acid
264433-01	2-Bromo-6- (trifluoromethyl) benzoic acid
418304-01	2-Hydroxy-6-pentadecyl Benzoic Acid
JH225090	2,6-BIS (TRIFLUOROMETHYL) BENZOIC ACID
PC1022054-01	2-Hydroxy-6- (trifluoromethoxy) benzoic acid
OR1098398-01	2-Methoxy-6- (methylthio) benzoic acid