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262291-90-7

262291-90-7 | Phenol, 2,6-dibromo-4-(1,3-dithiolan-2-yl)-

CAS No: 262291-90-7 Catalog No: AG002SDD MDL No:MFCD00662615

Product Description

Catalog Number:
AG002SDD
Chemical Name:
Phenol, 2,6-dibromo-4-(1,3-dithiolan-2-yl)-
CAS Number:
262291-90-7
Molecular Formula:
C9H8Br2OS2
Molecular Weight:
356.0972
MDL Number:
MFCD00662615
IUPAC Name:
2,6-dibromo-4-(1,3-dithiolan-2-yl)phenol
InChI:
InChI=1S/C9H8Br2OS2/c10-6-3-5(4-7(11)8(6)12)9-13-1-2-14-9/h3-4,9,12H,1-2H2
InChI Key:
XPGFLOLINYWQGV-UHFFFAOYSA-N
SMILES:
Brc1cc(cc(c1O)Br)C1SCCS1

Properties

Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.836g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
356.09g/mol
Monoisotopic Mass:
353.838g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
70.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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