1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene

C10H8Br2 — CID 11694985

IUPAC1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene
SMILES[2H]C([2H])=C(Br)c1ccccc1C(Br)=C([2H])[2H]
InChIInChI=1S/C10H8Br2/c1-7(11)9-5-3-4-6-10(9)8(2)12/h3-6H,1-2H2/i1D2,2D2
InChIKeyHNRJMPKFHPWSFS-LNLMKGTHSA-N
MW292.01 g/mol
LogP4.42
Rot. Bonds2

About 1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene

1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene (PubChem CID 11694985) has the molecular formula C10H8Br2 and a molecular weight of 292.01 g/mol. Its IUPAC name is 1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene.

Molecular Properties

Compound Name1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene
PubChem CID11694985
Molecular FormulaC10H8Br2
Molecular Weight292.01 g/mol
Exact Mass289.92
IUPAC Name1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene
SMILES[2H]C([2H])=C(Br)c1ccccc1C(Br)=C([2H])[2H]
InChIInChI=1S/C10H8Br2/c1-7(11)9-5-3-4-6-10(9)8(2)12/h3-6H,1-2H2/i1D2,2D2
InChIKeyHNRJMPKFHPWSFS-LNLMKGTHSA-N
XLogP4.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.01
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-bromo-2-(1-bromoethenyl)benzene
CID 87294952
2-(2-carbonobromidoylbenzoyl)benzoyl bromide
CID 19862066
2-(tribromomethyl)benzoyl bromide
CID 23326120
[2-(1,1,3,3,3-pentadeuterioprop-1-en-2-yl)phenyl]boronic acid
CID 168724554
2-cyanobenzoyl bromide
CID 154315508
lithium 1,2-bis(prop-1-en-2-yl)benzene
CID 22717015
1,2-bis(prop-1-en-2-yl)benzene;hydrogen peroxide
CID 175029396
formaldehyde;phthalic acid
CID 174659618
3,3-dibromo-2-(2-bromophenyl)prop-2-enenitrile
CID 135038265
1-(1-bromoethenyl)-4-phenylbenzene
CID 14972758
2,3-dihydroxybenzoyl bromide
CID 141115203
1-(1-bromoethenyl)-2-ethenyl-3-phenylbenzene
CID 142405469

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene?
The IUPAC name of 1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene (CID 11694985) is 1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene.
What is the SMILES notation for 1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene?
The canonical SMILES for 1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene is [2H]C([2H])=C(Br)c1ccccc1C(Br)=C([2H])[2H].
What is the InChIKey of 1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene?
The InChIKey is HNRJMPKFHPWSFS-LNLMKGTHSA-N. The full InChI is InChI=1S/C10H8Br2/c1-7(11)9-5-3-4-6-10(9)8(2)12/h3-6H,1-2H2/i1D2,2D2.
What are the key properties of 1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene?
1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene has a molecular weight of 292.01 g/mol, XLogP of 4.42, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(1-bromo-2,2-dideuterioethenyl)benzene is sourced from PubChem (CID 11694985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).