Home Halogens 3-bromobicyclo[1.1.1]pentane-1-carboxylic acid

3-bromobicyclo[1.1.1]pentane-1-carboxylic acid

CAS No.:
156329-70-3
Catalog Number:
AG019RV5
Molecular Formula:
C6H7BrO2
Molecular Weight:
191.0226
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Product Description
Catalog Number:
AG019RV5
Chemical Name:
3-bromobicyclo[1.1.1]pentane-1-carboxylic acid
CAS Number:
156329-70-3
Molecular Formula:
C6H7BrO2
Molecular Weight:
191.0226
MDL Number:
MFCD20621126
IUPAC Name:
3-bromobicyclo[1.1.1]pentane-1-carboxylic acid
InChI:
InChI=1S/C6H7BrO2/c7-6-1-5(2-6,3-6)4(8)9/h1-3H2,(H,8,9)
InChI Key:
VWLOBPGTTZYAPT-UHFFFAOYSA-N
SMILES:
OC(=O)C12CC(C1)(C2)Br
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.963g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.024g/mol
Monoisotopic Mass:
189.963g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties