Bis (2-Hydroxyethyl) 2-Hydroxyterephthalate (BHET-OH)

CAT: 0572-TRC-B302760-50MGSize: 50 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0572-TRC-B302760-50MGSize:50 mg

Selected

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

Quick Request Actions

CAS Number

2916556-97-1

Hazard Statement

No Data Available

Smiles

O=C(OCCO)C1=CC=C(C(=O)OCCO)C(O)=C1

Molecular Formula

C12H14O7

Molecular Weight

270.24

Chemical Information

Bis(2-hydroxyethyl) 2-hydroxyterephthalate

CAS Number	2916556-97-1
PubChem CID	168450142
IUPAC Name	bis(2-hydroxyethyl) 2-hydroxybenzene-1,4-dicarboxylate
Molecular Formula	C12H14O7
Molecular Weight	270.23
XLogP	0.5
Topological Polar Surface Area	113
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	8
Heavy Atom Count	19
Formal Charge	0
Complexity	304

SMILES

C1=CC(=C(C=C1C(=O)OCCO)O)C(=O)OCCO

InChI

InChI=1S/C12H14O7/c13-3-5-18-11(16)8-1-2-9(10(15)7-8)12(17)19-6-4-14/h1-2,7,13-15H,3-6H2

InChIKey

UDTYEWVUFIDJFZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2916556-97-1

CID: 168450142

Formula: C12H14O7

MW: 270.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	270.23
XLogP3	0.5
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	8
Exact Mass	270.07395278
Monoisotopic Mass	270.07395278
Topological Polar Surface Area	113 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	304
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
TRC-B847310-250MG	Bis(2-hydroxyethyl) Phthalate
B443860	Bis(2-hydroxyethyl) Terephthalate
TRC-B847310-500MG	Bis(2-hydroxyethyl) Phthalate
TRC-B847310-50MG	Bis(2-hydroxyethyl) Phthalate
TRC-N756610-50MG	NN'-Bis(2-hydroxyethyl)urea
TRC-B398130-250MG	Bisphenol A Bis(2-hydroxyethyl) Ether
TRC-N756610-100MG	NN'-Bis(2-hydroxyethyl)urea
D441906	Bis(2-hydroxyethyl)amine-d11
TRC-B443862-50G	Bis(2-hydroxyethyl) Terephthalate, ~85%
TRC-B847312-100MG	Bis(2-hydroxyethyl) Phthalate-d4