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72109-65-0 | 2,6-bis(bromomethyl)-4-methyl-phenol
CAS No: 72109-65-0 Catalog No: AG005K7Z MDL No:
Product Description
Catalog Number:
AG005K7Z
Chemical Name:
2,6-bis(bromomethyl)-4-methyl-phenol
CAS Number:
72109-65-0
Molecular Formula:
C9H10Br2O
Molecular Weight:
293.9831
IUPAC Name:
2,6-bis(bromomethyl)-4-methylphenol
InChI:
InChI=1S/C9H10Br2O/c1-6-2-7(4-10)9(12)8(3-6)5-11/h2-3,12H,4-5H2,1H3
InChI Key:
UWOPZQZEHASYEH-UHFFFAOYSA-N
SMILES:
BrCc1cc(C)cc(c1O)CBr
NSC Number:
19631
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.908g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.986g/mol
Monoisotopic Mass:
291.91g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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