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88174-44-1 | Benzaldehyde, 4-bromo-2,3,5,6-tetramethyl-
CAS No: 88174-44-1 Catalog No: AG008BPK MDL No:
Product Description
Catalog Number:
AG008BPK
Chemical Name:
Benzaldehyde, 4-bromo-2,3,5,6-tetramethyl-
CAS Number:
88174-44-1
Molecular Formula:
C11H13BrO
Molecular Weight:
241.1243
IUPAC Name:
4-bromo-2,3,5,6-tetramethylbenzaldehyde
InChI:
InChI=1S/C11H13BrO/c1-6-8(3)11(12)9(4)7(2)10(6)5-13/h5H,1-4H3
InChI Key:
XLAVJCMGFBXRHR-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)c(C)c(c(c1C)C)Br
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.015g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.128g/mol
Monoisotopic Mass:
240.015g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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