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773-37-5

773-37-5 | 1-(2-Bromoethyl)adamantane

CAS No: 773-37-5 Catalog No: AG005470 MDL No:MFCD00153991

Product Description

Catalog Number:
AG005470
Chemical Name:
1-(2-Bromoethyl)adamantane
CAS Number:
773-37-5
Molecular Formula:
C12H19Br
Molecular Weight:
243.1833
MDL Number:
MFCD00153991
IUPAC Name:
1-(2-bromoethyl)adamantane
InChI:
InChI=1S/C12H19Br/c13-2-1-12-6-9-3-10(7-12)5-11(4-9)8-12/h9-11H,1-8H2
InChI Key:
OVKAIZXCUJMFLN-UHFFFAOYSA-N
SMILES:
BrCCC12CC3CC(C2)CC(C1)C3

Properties

Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.067g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.188g/mol
Monoisotopic Mass:
242.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  

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