UCSF

ZINC00897283

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2005 9 No

Popular Name: Ethchlorvynol Ethchlorvynol

Find On: PubMed — Wikipedia — Google

CAS Number: 113-18-8

Other Names:

(E)-1-chloro-3-ethylpent-1-en-4-yn-3-ol

1-Chloro-3-ethyl-1-penten-4-yn-3-ol

1-Chloro-3-ethyl-1-penten-4-yn-3-ol; 1-Chloro-3-ethylpent-1-4-yn-3-ol; 1-Penten-4-yn-3-ol, 1-chloro-3-ethyl-; 3-(beta-Chlorovinyl)-1-pentyn-3-ol; 5-Chloro-3-ethylpent-1-yn-4-en-3-ol; A 71; AI3-23721; Aethyl-chlorvynol; Alvinol; Arvynol; BRN 1702245; C7H9C

1-chloro-3-ethyl-1-penten-4-yn-3-ol; 3-(beta-chlorovinyl)-1-pentyn-3-ol; Ethchlorvynol; beta-chlorovinyl ethyl ethynyl carbinol; ethyl beta-chlorovinyl ethynyl carbinol

1-Chloro-3-ethylpent-1-4-yn-3-ol

1-chloro-3-ethylpent-1-en-4-yn-3-ol

1-Penten-4-yn-3-ol, 1-chloro-3-ethyl-

113-18-8

113-18-8; C07833; Ethchlorvynol

113-18-8; D00704; Ethchlorvynol (JAN/USP/INN); Placidyl (TN)

3-(beta-Chlorovinyl)-1-pentyn-3-ol

5-Chloro-3-ethylpent-1-yn-4-en-3-ol

A 71

AC1NQXZT

AC1Q3HC3

Aethyl-chlorvynol

Aethyl-chlorvynol;Etchlorvinolo;Ethchlorovynol;Ethchlorvinol;Ethchlorvinyl;Ethclorvynol;Ethochlorvynol;Ethychlorvynol

AI3-23721

Alvinol

AR-1I7766

Arvynol

beta-Chlorovinyl ethyl ethynyl carbinol

beta-Chlorvinyl ethyl ethynyl carbinol

BRN 1702245

C07833

C7H9ClO

CHEBI:119469

CHEBI:4882

CHEMBL591

CID5281077

D00704

DAP000163

DB00189

DEA No. 2540

Etchlorvinolo

Etclorvinol

Etclorvinol [INN-Spanish]

etclorvinol; ethchlorvynol; ethchlorvynolum

Ethchlorovynol

Ethchlorvinol

Ethchlorvinyl

Ethchlorvynol (BAN

Ethchlorvynol (JAN/USP/INN)

Ethchlorvynol [USAN:INN:BAN]

Ethchlorvynolum

Ethchlorvynolum [INN-Latin]

Ethclorvynol

Ethochlorvynol

Ethychlorvynol

Ethyl beta-chlorovinyl ethynyl carbinol

FDA

HSDB 3079

INN

LS-102223

MolPort-004-285-854

Normonson

Normosan

Normoson

Nostel

Nromoson

NSC 30372

Placidil

Placidyl

Placidyl (TN)

Roeridorm

Serenesil

Serenil

Serensil

Serensiloline

UNII-6EIM3851UZ

USP)

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.56 0.93 -4.22 1 1 0 20 144.601 2 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.43e-01 g/l DrugBank-approved
PUBCHEM_PATENT_ID EP0117693A2; EP0129284A2; EP0129285A2; EP0129285B1; EP0234600A1; EP0242589A2; EP0353015A2; EP0386232B2; EP0388954B1; EP0416575A3; EP0475160B1; EP0626850A1; EP0705085B1; EP0712293A1; EP0740548A1; EP0797442A1; EP0818994A1; EP0901793A1; EP0906315A1; EP091217 IBM Patent Data

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Analogs ( Draw Identity 99% 90% 80% 70% )