(2,4-dibromophenyl) N-ethenylcarbamate

C9H7Br2NO2 — CID 71409205

IUPAC(2,4-dibromophenyl) N-ethenylcarbamate
SMILESC=CNC(=O)Oc1ccc(Br)cc1Br
InChIInChI=1S/C9H7Br2NO2/c1-2-12-9(13)14-8-4-3-6(10)5-7(8)11/h2-5H,1H2,(H,12,13)
InChIKeyLSAHGOIFKRXNFV-UHFFFAOYSA-N
MW320.97 g/mol
LogP3.44
Rot. Bonds2

About (2,4-dibromophenyl) N-ethenylcarbamate

(2,4-dibromophenyl) N-ethenylcarbamate (PubChem CID 71409205) has the molecular formula C9H7Br2NO2 and a molecular weight of 320.97 g/mol. Its IUPAC name is (2,4-dibromophenyl) N-ethenylcarbamate.

Molecular Properties

Compound Name(2,4-dibromophenyl) N-ethenylcarbamate
PubChem CID71409205
Molecular FormulaC9H7Br2NO2
Molecular Weight320.97 g/mol
Exact Mass318.88
IUPAC Name(2,4-dibromophenyl) N-ethenylcarbamate
SMILESC=CNC(=O)Oc1ccc(Br)cc1Br
InChIInChI=1S/C9H7Br2NO2/c1-2-12-9(13)14-8-4-3-6(10)5-7(8)11/h2-5H,1H2,(H,12,13)
InChIKeyLSAHGOIFKRXNFV-UHFFFAOYSA-N
XLogP3.44
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.97
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

bis(2,4-dibromophenyl) carbonate
CID 54492294
(2,4-dibromophenyl) carbonofluoridate
CID 165349274
(2,4-dibromophenyl) 2-hydroxyacetate
CID 130668337
(2,4-dibromophenyl) cyclopropanecarboxylate
CID 836257
(2,4-dibromophenyl) 4-benzoylbenzoate
CID 2316078
(2,4-dibromophenyl) 2-fluorobenzoate
CID 23011822
(3,4-dimethylphenyl) N-ethenylcarbamate
CID 71409278
(4-bromo-2-fluorophenyl) prop-2-enoate
CID 174643250
4-(2,4-dibromophenoxy)butanehydrazide
CID 63576618
(4-bromo-2-methylphenyl) N-ethylcarbamate
CID 54003233
(2,4-dibromophenyl) 4-nitrobenzoate
CID 1378798
methyl 4-bromo-2-ethenoxybenzoate
CID 135381779

Frequently Asked Questions

What is the IUPAC name of (2,4-dibromophenyl) N-ethenylcarbamate?
The IUPAC name of (2,4-dibromophenyl) N-ethenylcarbamate (CID 71409205) is (2,4-dibromophenyl) N-ethenylcarbamate.
What is the SMILES notation for (2,4-dibromophenyl) N-ethenylcarbamate?
The canonical SMILES for (2,4-dibromophenyl) N-ethenylcarbamate is C=CNC(=O)Oc1ccc(Br)cc1Br.
What is the InChIKey of (2,4-dibromophenyl) N-ethenylcarbamate?
The InChIKey is LSAHGOIFKRXNFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7Br2NO2/c1-2-12-9(13)14-8-4-3-6(10)5-7(8)11/h2-5H,1H2,(H,12,13).
What are the key properties of (2,4-dibromophenyl) N-ethenylcarbamate?
(2,4-dibromophenyl) N-ethenylcarbamate has a molecular weight of 320.97 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dibromophenyl) N-ethenylcarbamate is sourced from PubChem (CID 71409205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).