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1189441-55-1 | p-Methoxybenzaldehyde-13C6
CAS No: 1189441-55-1 Catalog No: AG0094W3 MDL No:
Product Description
Catalog Number:
AG0094W3
Chemical Name:
p-Methoxybenzaldehyde-13C6
CAS Number:
1189441-55-1
IUPAC Name:
4-methoxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-carbaldehyde
InChI:
InChI=1S/C8H8O2/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3/i2+1,3+1,4+1,5+1,7+1,8+1
InChI Key:
ZRSNZINYAWTAHE-CLQMYPOBSA-N
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.073g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
6
Molecular Weight:
142.104g/mol
Monoisotopic Mass:
142.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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