Products for Research Use Only
RegisterLogin

Mono(2-(1-hydroxyethyl)hexyl) Phthalate

CAT: 0572-TRC-M546530-25MGSize: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-M546530-25MGSize:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
88144-76-7
Hazard Statement
No Data Available
Smiles
CCCCC(COC(=O)c1ccccc1)C(C)O.O=C=O
Molecular Formula
C15 H22 O3 . C O2
Molecular Weight
294.343
InChI
InChI=1S/C15H22O3.CO2/c1-3-4-8-14(12(2)16)11-18-15(17)13-9-6-5-7-10-13;2-1-3/h5-7,9-10,12,14,16H,3-4,8,11H2,1-2H3;
Additionnal Information
IUPAC name: carbon dioxide;2-(1-hydroxyethyl)hexyl benzoate
Shipping Conditions
Room Temperature

Chemical Information

2-(2-(1-Hydroxyethyl)hexoxycarbonyl)benzoic acid
CAS Number88144-76-7
PubChem CID186444
IUPAC Name2-[2-(1-hydroxyethyl)hexoxycarbonyl]benzoic acid
Molecular FormulaC16H22O5
Molecular Weight294.34
XLogP3.3
Topological Polar Surface Area83.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count21
Formal Charge0
Complexity342
SMILES
CCCCC(COC(=O)C1=CC=CC=C1C(=O)O)C(C)O
InChI
InChI=1S/C16H22O5/c1-3-4-7-12(11(2)17)10-21-16(20)14-9-6-5-8-13(14)15(18)19/h5-6,8-9,11-12,17H,3-4,7,10H2,1-2H3,(H,18,19)
InChIKey
VIBGBTLSHLRRQL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2-(1-Hydroxyethyl)hexoxycarbonyl)benzoic acid
CAS: 88144-76-7
CID: 186444
Formula: C16H22O5
MW: 294.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight294.34
XLogP33.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass294.14672380
Monoisotopic Mass294.14672380
Topological Polar Surface Area83.8 Ų
Heavy Atom Count21
Formal Charge0
Complexity342
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-M546540-250MGMono(2-(2-hydroxyethyl)hexyl) Phthalate
TRC-M546542-50MGMono(2-(2-hydroxyethyl)hexyl) Phthalate-d4
TRC-M524780-50MGMono-2-(1-oxoethyl)hexyl Phthalate
TRC-M525585-10MGMono[2-(carboxymethyl)hexyl] Phthalate
TRC-M525585-1MGMono[2-(carboxymethyl)hexyl] Phthalate
TRC-M525585-5MGMono[2-(carboxymethyl)hexyl] Phthalate
TRC-M524782-25MGMono-2-(1-oxoethyl)hexyl-d4 Phthalate
TRC-M525587-10MGMono[2-(carboxymethyl)hexyl] Phthalate-d4
TRC-M525587-1MGMono[2-(carboxymethyl)hexyl] Phthalate-d4
TRC-M566605-250MGMono(5-Methyl-2-hexyl) Phthalate

Alternative Products

CatalogName
165009Mono (2-​ (1-​hydroxyethyl) ​hexyl) Phthalate
sc-484604Mono (2- (1-hydroxyethyl) hexyl) phthalate
165011Mono (2-​ (2-​hydroxyethyl) ​hexyl) Phthalate
165010Mono (2-​ (1-​hydroxyethyl) ​hexyl) Phthalate-d4
sc-484605Mono (2- (1-hydroxyethyl) hexyl) phthalate-d4
sc-484609Mono (2- (2-hydroxyethyl) hexyl) phthalate-d4
165012Mono (2-​ (2-​hydroxyethyl) ​hexyl) Phthalate-d4
165005Mono-2- (1-oxoethyl) hexyl Phthalate
282931-01Mono[2- (carboxymethyl) hexyl] phthalate
MBS6073589-01Mono[2-(carboxymethyl)hexyl] Phthalate

Popular Products