Home Other Building Blocks P-CRESOL-2,3,5,6-D4,OD

P-CRESOL-2,3,5,6-D4,OD

CAS No.:
3646-98-8
Catalog Number:
AG00C5E9
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C5E9
Chemical Name:
P-CRESOL-2,3,5,6-D4,OD
CAS Number:
3646-98-8
MDL Number:
MFCD01073984
IUPAC Name:
1,2,4,5-tetradeuterio-3-deuteriooxy-6-methylbenzene
InChI:
InChI=1S/C7H8O/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3/i2D,3D,4D,5D/hD
InChI Key:
IWDCLRJOBJJRNH-MDXQMYCFSA-N
Properties
Complexity:
62.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.089g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
5  
Molecular Weight:
113.171g/mol
Monoisotopic Mass:
113.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties