Name: Name:Haloperidol-d4
Brand: Angene
SKU: AG0081IZ
Rating: 90 (10 reviews)

Haloperidol-d4

CAS No.:

1189986-59-1

Catalog Number:

AG0081IZ

Molecular Formula:

C21H19ClD4FNO2

Molecular Weight:

379.8889

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

1mg

≥99% deuterated forms (d<sub>1</sub>-d<sub>4</sub>)

1 week

United States

$318

- +

Catalog Number:

AG0081IZ

Chemical Name:

Haloperidol-d4

CAS Number:

1189986-59-1

Molecular Formula:

C21H19ClD4FNO2

Molecular Weight:

379.8889

MDL Number:

MFCD09842548

IUPAC Name:

4-[4-(4-chloro-2,3,5,6-tetradeuteriophenyl)-4-hydroxypiperidin-1-yl]-1-(4-fluorophenyl)butan-1-one

InChI:

InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2/i5D,6D,7D,8D

InChI Key:

LNEPOXFFQSENCJ-KDWZCNHSSA-N

SMILES:

Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1c([2H])c([2H])c(c(c1[2H])[2H])Cl

Complexity:

451

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

379.165g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

379.893g/mol

Monoisotopic Mass:

379.165g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2