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Home > Bromides > 868860-22-4

868860-22-4

868860-22-4 | Benzenemethanol, 3,5-dibromo-4-methyl-

CAS No: 868860-22-4 Catalog No: AG01FCUG MDL No:

Product Description

Catalog Number:
AG01FCUG
Chemical Name:
Benzenemethanol, 3,5-dibromo-4-methyl-
CAS Number:
868860-22-4
Molecular Formula:
C8H8Br2O
Molecular Weight:
279.9565
IUPAC Name:
(3,5-dibromo-4-methylphenyl)methanol
InChI:
InChI=1S/C8H8Br2O/c1-5-7(9)2-6(4-11)3-8(5)10/h2-3,11H,4H2,1H3
InChI Key:
YBJGYASYCYJUDJ-UHFFFAOYSA-N
SMILES:
OCc1cc(Br)c(c(c1)Br)C

Properties

Complexity:
117  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.892g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
279.959g/mol
Monoisotopic Mass:
277.894g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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