2-Chloro-N-((furan-2-yl)methyl)acetamide

C7H8ClNO2CAS 40914-13-4173.60 g/mol

Open in Covalent MOL file
OHNOCl
Alkyl halideAmide

Properties

Molecular formula
C7H8ClNO2
Molar mass
173.60 g/mol
Exact mass
173.0244 Da
logP
1.13Crippen estimate
Polar surface area
42.2 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
3

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
40914-13-4
SMILES
C1=COC(=C1)CNC(=O)CCl
InChIKey
DRDCOQBVIBGWCZ-UHFFFAOYSA-N
InChI
InChI=1S/C7H8ClNO2/c8-4-7(10)9-5-6-2-1-3-11-6/h1-3H,4-5H2,(H,9,10)

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Names and synonyms

1 names
  • 2-Chloro-N-(2-furylmethyl)acetamide

Work with 2-Chloro-N-((furan-2-yl)methyl)acetamide

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

[(Furan-2-yl)methyl]thiourea56541-07-249 % similar Benzyl(furan-2-ylmethyl)amine4439-53-641 % similar 2-Furanpropanoic acid935-13-739 % similar D-2-Furylalanine110772-46-839 % similar 3-Furan-2-ylalanine127682-08-039 % similar Furfurylthiol acetate13678-68-738 % similar 2-Chloro-N-(2-chlorophenyl)acetamide3289-76-738 % similar Furfural acetate623-17-638 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Chloro-3-methoxy-2-methylpyridine N-oxide122307-41-9 3-Aminobenzoic acid hydrochloride15151-51-6 2-Pyridylacetic acid hydrochloride16179-97-8 Trigonelline hydrochloride6138-41-6 3-Pyridylacetic acid hydrochloride6419-36-9 4-Pyridineacetic acid hydrochloride6622-91-9 4-Methylnicotinic acid hydrochloride94015-05-1

Elsewhere

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