(2-chlorophenyl) N-ethenylcarbamate

C9H8ClNO2 — CID 71409284

IUPAC(2-chlorophenyl) N-ethenylcarbamate
SMILESC=CNC(=O)Oc1ccccc1Cl
InChIInChI=1S/C9H8ClNO2/c1-2-11-9(12)13-8-6-4-3-5-7(8)10/h2-6H,1H2,(H,11,12)
InChIKeyRGTNHKOGNYGEGA-UHFFFAOYSA-N
MW197.62 g/mol
LogP2.57
Rot. Bonds2

About (2-chlorophenyl) N-ethenylcarbamate

(2-chlorophenyl) N-ethenylcarbamate (PubChem CID 71409284) has the molecular formula C9H8ClNO2 and a molecular weight of 197.62 g/mol. Its IUPAC name is (2-chlorophenyl) N-ethenylcarbamate.

Molecular Properties

Compound Name(2-chlorophenyl) N-ethenylcarbamate
PubChem CID71409284
Molecular FormulaC9H8ClNO2
Molecular Weight197.62 g/mol
Exact Mass197.02
IUPAC Name(2-chlorophenyl) N-ethenylcarbamate
SMILESC=CNC(=O)Oc1ccccc1Cl
InChIInChI=1S/C9H8ClNO2/c1-2-11-9(12)13-8-6-4-3-5-7(8)10/h2-6H,1H2,(H,11,12)
InChIKeyRGTNHKOGNYGEGA-UHFFFAOYSA-N
XLogP2.57
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.62
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-chlorophenyl) N-(2-oxoethyl)carbamate
CID 83821380
(2-chlorophenyl) pent-4-enoate
CID 66826844
2-[(2-chlorophenoxy)carbonylamino]propanoic acid
CID 83825067
(2-chlorophenyl) N-[2-(methylamino)ethyl]carbamate
CID 83823725
(2-chlorophenyl) N-(2-aminopropyl)carbamate
CID 83823727
(2-chlorophenyl) prop-2-ynoate
CID 130728916
(2-chlorophenyl) (2S)-2-(methylamino)propanoate
CID 175000753
(2-chlorophenyl) 3-aminopropanoate
CID 82112337
(2-chlorophenyl) 2-aminoacetate;hydrochloride
CID 174643390
bis(2-chlorophenyl) 2-methylbut-2-enedioate
CID 54358019
5-[(2-chlorophenoxy)carbonylamino]-2-hydroxybenzoic acid
CID 19001066
(2-chlorophenyl) 2-methoxyacetate
CID 542147

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl) N-ethenylcarbamate?
The IUPAC name of (2-chlorophenyl) N-ethenylcarbamate (CID 71409284) is (2-chlorophenyl) N-ethenylcarbamate.
What is the SMILES notation for (2-chlorophenyl) N-ethenylcarbamate?
The canonical SMILES for (2-chlorophenyl) N-ethenylcarbamate is C=CNC(=O)Oc1ccccc1Cl.
What is the InChIKey of (2-chlorophenyl) N-ethenylcarbamate?
The InChIKey is RGTNHKOGNYGEGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClNO2/c1-2-11-9(12)13-8-6-4-3-5-7(8)10/h2-6H,1H2,(H,11,12).
What are the key properties of (2-chlorophenyl) N-ethenylcarbamate?
(2-chlorophenyl) N-ethenylcarbamate has a molecular weight of 197.62 g/mol, XLogP of 2.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl) N-ethenylcarbamate is sourced from PubChem (CID 71409284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).