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Phenol-d6

CAS No.:
13127-88-3
Catalog Number:
AG009AMR
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG009AMR
Chemical Name:
Phenol-d6
CAS Number:
13127-88-3
MDL Number:
MFCD00002144
IUPAC Name:
1,2,3,4,5-pentadeuterio-6-deuteriooxybenzene
InChI:
InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H/i1D,2D,3D,4D,5D/hD
InChI Key:
ISWSIDIOOBJBQZ-QNKSCLMFSA-N
EC Number:
236-063-8
Properties
Complexity:
46.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
100.08g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
6  
Molecular Weight:
100.15g/mol
Monoisotopic Mass:
100.08g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties