(1R)-1-bromo-1-chloroethane

C2H4BrCl — CID 96570687

IUPAC(1R)-1-bromo-1-chloroethane
SMILESC[C@H](Cl)Br
InChIInChI=1S/C2H4BrCl/c1-2(3)4/h2H,1H3/t2-/m0/s1
InChIKeyQMSVNDSDEZTYAS-REOHCLBHSA-N
MW143.41 g/mol
LogP1.97
Rot. Bonds

About (1R)-1-bromo-1-chloroethane

(1R)-1-bromo-1-chloroethane (PubChem CID 96570687) has the molecular formula C2H4BrCl and a molecular weight of 143.41 g/mol. Its IUPAC name is (1R)-1-bromo-1-chloroethane.

Molecular Properties

Compound Name(1R)-1-bromo-1-chloroethane
PubChem CID96570687
Molecular FormulaC2H4BrCl
Molecular Weight143.41 g/mol
Exact Mass141.92
IUPAC Name(1R)-1-bromo-1-chloroethane
SMILESC[C@H](Cl)Br
InChIInChI=1S/C2H4BrCl/c1-2(3)4/h2H,1H3/t2-/m0/s1
InChIKeyQMSVNDSDEZTYAS-REOHCLBHSA-N
XLogP1.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.41
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

bromo-chloro-dimethylphosphanium
CID 23415191
chloro(trimethyl)phosphanium
CID 15830224
2-bromo-2-methylpropane;2-bromopropane;bis(2-chloropropane)
CID 157404199
magnesium;2-chloropropane;dichloride
CID 158508799
(2S,3S)-2,3-dibromobutane
CID 23270428
CID 118356908
CID 118356908
(1R,2R)-1,2-dibromo-1,2-dichloroethane
CID 98044589
2-bromo-1-chloropropane
CID 18175
1-bromo-2-chloropropane;2-chloropropane
CID 174371360
bromo(dichloro)methane;chlorosilane
CID 173326151
2-chloropropane;bis(N-methylmethanamine)
CID 88525662
lithium;magnesium;2-chloropropane;trichloride
CID 175456910

Frequently Asked Questions

What is the IUPAC name of (1R)-1-bromo-1-chloroethane?
The IUPAC name of (1R)-1-bromo-1-chloroethane (CID 96570687) is (1R)-1-bromo-1-chloroethane.
What is the SMILES notation for (1R)-1-bromo-1-chloroethane?
The canonical SMILES for (1R)-1-bromo-1-chloroethane is C[C@H](Cl)Br.
What is the InChIKey of (1R)-1-bromo-1-chloroethane?
The InChIKey is QMSVNDSDEZTYAS-REOHCLBHSA-N. The full InChI is InChI=1S/C2H4BrCl/c1-2(3)4/h2H,1H3/t2-/m0/s1.
What are the key properties of (1R)-1-bromo-1-chloroethane?
(1R)-1-bromo-1-chloroethane has a molecular weight of 143.41 g/mol, XLogP of 1.97, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-bromo-1-chloroethane is sourced from PubChem (CID 96570687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).