Chlorphenesin carbamate

C₁₀H₁₂ClNO₄CAS 886-74-8245.66 g/mol

Open in Covalent MOL file

Alcohol Aryl halide Ether

Properties

Molecular formula: C₁₀H₁₂ClNO₄
Molar mass: 245.66 g/mol
Exact mass: 245.0455 Da
Melting point: 89–91 °C
logP: 1.59Crippen estimate
Polar surface area: 82.8 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 5

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

886-74-8

SMILES

N=C(O)OCC(O)COc1ccc(Cl)cc1

InChIKey

SKPLBLUECSEIFO-UHFFFAOYSA-N

InChI

InChI=1S/C10H12ClNO4/c11-7-1-3-9(4-2-7)15-5-8(13)6-16-10(12)14/h1-4,8,13H,5-6H2,(H2,12,14)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

12 names

1,2-Propanediol, 3-(4-chlorophenoxy)-, 1-carbamate
1,2-Propanediol, 3-(p-chlorophenoxy)-, 1-carbamate
Carbamic acid, 3-(p-chlorophenoxy)-2-hydroxypropyl ester
U-19,646
3-(p-Chlorophenoxy)-2-hydroxypropyl carbamate
3-[p-Chlorophenoxy]-1,2-propanediol-1-carbamate
Maolate
3-(4-Chlorophenoxy)-2-hydroxypropyl carbamate
Rinlaxer
U 19646
NSC 82943
Rhnesicn

Work with Chlorphenesin carbamate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Chlorphenesin104-29-057 % similar Methocarbamol532-03-653 % similar 4-Chlorophenoxyacetic acid122-88-341 % similar Felbamate25451-15-441 % similar N,N′-trans-1,4-Cyclohexanediylbis[2-(4-chlorophenoxy)acetamide]1597403-47-840 % similar Bis(p-chlorophenoxy)methane555-89-539 % similar 3-(4-Chlorophenoxy)propanoic acid3284-79-539 % similar Atenolol29122-68-738 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-(3-Chloropropoxy)-1-methoxy-4-nitrobenzene92878-95-0

Elsewhere

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