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2,2'-Methylenebis(4-bromophenol)

CAT: 0572-TRC-M304210-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-M304210-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
78563-03-8
Synonyms
Bis(2-hydroxy-5-bromophenyl)methane;
Hazard Statement
No Data Available
Smiles
COc1ccc2[C@@H]3CC[C@]4(C)[C@H](CC[C@@H]4[C@@H]3CC(O)c2c1)OC5CCCCO5
Molecular Formula
C24 H34 O4
Molecular Weight
386.524
InChI
InChI=1S/C24H34O4/c1-24-11-10-17-16-7-6-15(26-2)13-19(16)21(25)14-18(17)20(24)8-9-22(24)28-23-5-3-4-12-27-23/h6-7,13,17-18,20-23,25H,3-5,8-12,14H2,1-2H3/t17-,18+,20+,21?,22-,23?,24-/m0/s1
Additionnal Information
IUPAC name: (8R,9R,13S,14R,17S)-3-methoxy-13-methyl-17-(oxan-2-yloxy)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-6-ol
Shipping Conditions
Room Temperature

Chemical Information

2,2'-Methylenebis(4-bromophenol)

Phenol, 2,2'-methylenebis(4-bromo- has been reported in Odonthalia corymbifera with data available.

CAS Number78563-03-8
PubChem CID3061033
IUPAC Name4-bromo-2-[(5-bromo-2-hydroxyphenyl)methyl]phenol
Molecular FormulaC13H10Br2O2
Molecular Weight358.02
XLogP4.4
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity226
SMILES
C1=CC(=C(C=C1Br)CC2=C(C=CC(=C2)Br)O)O
InChI
InChI=1S/C13H10Br2O2/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17/h1-4,6-7,16-17H,5H2
InChIKey
FGDRHERYMWECPV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,2'-Methylenebis(4-bromophenol)
CAS: 78563-03-8
CID: 3061033
Formula: C13H10Br2O2
MW: 358.02
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight358.02
XLogP34.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass357.90271
Monoisotopic Mass355.90475
Topological Polar Surface Area40.5 Ų
Heavy Atom Count17
Formal Charge0
Complexity226
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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419517-012,2'-Methylenebis (4-bromophenol)
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AN KA 0092-012- (2-aminoethyl) -4-bromophenol
430150-014-Amino-2-bromophenol
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