Terbutaline 3,5-Dibenzyl Ether

HCID 21450034

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 28924-25-6
Standard SMILES: CC(C)(C)NCC(O)c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1
InChIKey: QFBOZEACKUKEBR-UHFFFAOYSA-N
Molecular formula: C26H31NO3
Average molar mass: 405.5 g/mol
Monoisotopic mass: 405.23039385

Names & identifiers

Preferred name: Terbutaline 3,5-Dibenzyl Ether
IUPAC: 1-[3,5-bis(phenylmethoxy)phenyl]-2-(tert-butylamino)ethanol
English name: 3,5-Dibenzyloxy terbutalline
Molecular formula: C26H31NO3
Molecular weight: 405.53

Names & synonyms

28924-25-6Terbutaline 3,5-Dibenzyl Ether1-[3,5-bis(phenylmethoxy)phenyl]-2-(tert-butylamino)ethanolTerbutaline Impurity 173,5-Dibenzyloxy terbutalline1-(3,5-Bis(benzyloxy)phenyl)-2-(tert-butylamino)ethanolSCHEMBL11702384DTXSID30614073AKOS030255579Benzenemethanol, a-[[(1,1-dimethylethyl)amino]methyl]-3,5-bis(phenylmethoxy)-H57715Benzenemethanol, alpha-[[(1,1-dimethylethyl)amino]methyl]-3,5-bis(phenylmethoxy)-

Show more names

Reaxys ID: 3071898Terbutaline Impurity 16Terbutaline EP Impurity GN6 TRIFLUROACETYL L-LYSINE (TFAL)1-(3,5-bis(benzyloxy)phenyl)-3-phenylpropan-1-one1-[3,5-Bis(benzyloxy)phenyl]-2-(tert-butylamino)ethanol1-(3,5-bis(benzyloxy)phenyl)-2-(tert-butylamino)ethan-1-ol hydrochloridea-[[(1,1-Dimethylethyl)amino]methyl]-3,5-bis(phenylmethoxy)bnzenemethanol

Database identifiers

CAS: 28924-25-6
PubChem CID: 21450034
DTXSID: DTXSID30614073

Properties

Computed structural properties

XLogP: 4.6
Topological polar surface area: 50.7 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 10
Heavy atoms: 30
Formal charge: 0
Complexity: 435

Physicochemical properties

Melting point: 124 · 124-126C
Density: 1.111 · 1.111
storage temp.: Refrigerator
solubility: Chloroform
form: Solid
color: White to Off-White

Chemistry & industry

Applications

UsesIntermediate for the preparation of Terbutaline.

Upstream & downstream products

Downstream products

5-(1-Hydroxy-2-tert-butylamino-ethyl)benzene-1,3-diol

Suppliers48 total

宁波君龙新材料有限公司0574 88552218 18969899212 · [email protected]

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

济南百隆化学有限公司[email protected] · [email protected]

武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]

广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…