methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate

C15H11Cl2NO4 — CID 3269108

IUPACmethyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate
SMILESCOC(=O)c1ccccc1OC(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C15H11Cl2NO4/c1-21-14(19)9-5-2-3-8-12(9)22-15(20)18-11-7-4-6-10(16)13(11)17/h2-8H,1H3,(H,18,20)
InChIKeyYDPILRXZNZTJID-UHFFFAOYSA-N
MW340.16 g/mol
LogP4.39
Rot. Bonds3

About methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate

methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate (PubChem CID 3269108) has the molecular formula C15H11Cl2NO4 and a molecular weight of 340.16 g/mol. Its IUPAC name is methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate.

Molecular Properties

Compound Namemethyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate
PubChem CID3269108
Molecular FormulaC15H11Cl2NO4
Molecular Weight340.16 g/mol
Exact Mass339.01
IUPAC Namemethyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate
SMILESCOC(=O)c1ccccc1OC(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C15H11Cl2NO4/c1-21-14(19)9-5-2-3-8-12(9)22-15(20)18-11-7-4-6-10(16)13(11)17/h2-8H,1H3,(H,18,20)
InChIKeyYDPILRXZNZTJID-UHFFFAOYSA-N
XLogP4.39
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.16
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[(2,3-dichlorophenyl)carbamoyl]phenyl] acetate
CID 3368365
methyl 2-[(2,3-dichlorophenyl)carbamoylamino]-4,5-dimethoxybenzoate
CID 1296628
methyl 2-chloro-3-methoxybenzoate
CID 10262208
2-chloro-N-(2-chlorophenyl)-3-methoxybenzamide
CID 45051392
(3,4-dichlorophenyl) N-(2,3-dichlorophenyl)carbamate
CID 4093750
methyl 2-(2-hydroxyphenoxy)carbonyloxybenzoate
CID 69027946
methyl 2-(2-chlorophenyl)benzoate
CID 1393589
(2-methoxycarbonylphenyl) 2,4-dichlorobenzoate
CID 837741
[1-(2,3-dichloroanilino)-1-oxopropan-2-yl] 2,3-dimethoxybenzoate
CID 42963207
methyl 2-[[5-(2,3-dichlorophenyl)furan-2-carbonyl]amino]benzoate
CID 3641679
N-(2,3-dichlorophenyl)-2-iodobenzamide
CID 1043515
methyl 2-[(5-chloronaphthalene-1-carbonyl)amino]benzoate
CID 17102102

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate?
The IUPAC name of methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate (CID 3269108) is methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate.
What is the SMILES notation for methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate?
The canonical SMILES for methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate is COC(=O)c1ccccc1OC(=O)Nc1cccc(Cl)c1Cl.
What is the InChIKey of methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate?
The InChIKey is YDPILRXZNZTJID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NO4/c1-21-14(19)9-5-2-3-8-12(9)22-15(20)18-11-7-4-6-10(16)13(11)17/h2-8H,1H3,(H,18,20).
What are the key properties of methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate?
methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate has a molecular weight of 340.16 g/mol, XLogP of 4.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2,3-dichlorophenyl)carbamoyloxy]benzoate is sourced from PubChem (CID 3269108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).