[4-(4-bromophenyl)phenyl] carbamate

C13H10BrNO2 — CID 151826430

IUPAC[4-(4-bromophenyl)phenyl] carbamate
SMILESNC(=O)Oc1ccc(-c2ccc(Br)cc2)cc1
InChIInChI=1S/C13H10BrNO2/c14-11-5-1-9(2-6-11)10-3-7-12(8-4-10)17-13(15)16/h1-8H,(H2,15,16)
InChIKeySDSFBLXYWUWFEV-UHFFFAOYSA-N
MW292.13 g/mol
LogP3.57
Rot. Bonds2

About [4-(4-bromophenyl)phenyl] carbamate

[4-(4-bromophenyl)phenyl] carbamate (PubChem CID 151826430) has the molecular formula C13H10BrNO2 and a molecular weight of 292.13 g/mol. Its IUPAC name is [4-(4-bromophenyl)phenyl] carbamate.

Molecular Properties

Compound Name[4-(4-bromophenyl)phenyl] carbamate
PubChem CID151826430
Molecular FormulaC13H10BrNO2
Molecular Weight292.13 g/mol
Exact Mass290.99
IUPAC Name[4-(4-bromophenyl)phenyl] carbamate
SMILESNC(=O)Oc1ccc(-c2ccc(Br)cc2)cc1
InChIInChI=1S/C13H10BrNO2/c14-11-5-1-9(2-6-11)10-3-7-12(8-4-10)17-13(15)16/h1-8H,(H2,15,16)
InChIKeySDSFBLXYWUWFEV-UHFFFAOYSA-N
XLogP3.57
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.13
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(4-bromophenyl)phenyl] 2,2-dimethylpropanoate
CID 22447512
2-[4-(4-bromophenyl)phenoxy]acetamide
CID 7949184
(3,5-dibromophenyl) carbamate
CID 175177777
O-[4-(4-bromophenyl)phenyl]hydroxylamine
CID 71082038
(4-bromophenyl) N-oxamoylcarbamate
CID 171934087
1-bromo-4-[4-[4-(4-bromophenyl)phenyl]phenyl]benzene
CID 59775505
(4-bromophenyl) cycloprop-2-ene-1-carboxylate
CID 175603214
(4-acetylphenyl) carbamate;ethane
CID 163253714
(4-ethylphenyl) carbamate
CID 1269945
(4-propan-2-ylphenyl) carbamate
CID 57008477
[4-(4-oxocyclohexen-1-yl)phenyl] carbamate
CID 162263206
(4-bromophenyl) N-(sulfonylmethyl)carbamate
CID 87609424

Frequently Asked Questions

What is the IUPAC name of [4-(4-bromophenyl)phenyl] carbamate?
The IUPAC name of [4-(4-bromophenyl)phenyl] carbamate (CID 151826430) is [4-(4-bromophenyl)phenyl] carbamate.
What is the SMILES notation for [4-(4-bromophenyl)phenyl] carbamate?
The canonical SMILES for [4-(4-bromophenyl)phenyl] carbamate is NC(=O)Oc1ccc(-c2ccc(Br)cc2)cc1.
What is the InChIKey of [4-(4-bromophenyl)phenyl] carbamate?
The InChIKey is SDSFBLXYWUWFEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrNO2/c14-11-5-1-9(2-6-11)10-3-7-12(8-4-10)17-13(15)16/h1-8H,(H2,15,16).
What are the key properties of [4-(4-bromophenyl)phenyl] carbamate?
[4-(4-bromophenyl)phenyl] carbamate has a molecular weight of 292.13 g/mol, XLogP of 3.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-bromophenyl)phenyl] carbamate is sourced from PubChem (CID 151826430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).