Home Halogens 4-(Adamantan-1-yl)-2-bromophenol

4-(Adamantan-1-yl)-2-bromophenol

CAS No.:
63013-55-8
Catalog Number:
AG00EC1M
Molecular Formula:
C16H19BrO
Molecular Weight:
307.2255
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG00EC1M
Chemical Name:
4-(Adamantan-1-yl)-2-bromophenol
CAS Number:
63013-55-8
Molecular Formula:
C16H19BrO
Molecular Weight:
307.2255
MDL Number:
MFCD01825625
IUPAC Name:
4-(1-adamantyl)-2-bromophenol
InChI:
InChI=1S/C16H19BrO/c17-14-6-13(1-2-15(14)18)16-7-10-3-11(8-16)5-12(4-10)9-16/h1-2,6,10-12,18H,3-5,7-9H2
InChI Key:
CGDOSRCXWZXYLT-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1Br)C12CC3CC(C2)CC(C1)C3
Properties
Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.062g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
307.231g/mol
Monoisotopic Mass:
306.062g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7  
Properties