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52221-92-8

52221-92-8 | 3-(2-Bromo-phenyl);-propan-1-ol

CAS No: 52221-92-8 Catalog No: AG003I0E MDL No:MFCD09028685

Product Description

Catalog Number:
AG003I0E
Chemical Name:
3-(2-Bromo-phenyl);-propan-1-ol
CAS Number:
52221-92-8
Molecular Formula:
C9H11BrO
Molecular Weight:
215.0870
MDL Number:
MFCD09028685
IUPAC Name:
3-(2-bromophenyl)propan-1-ol
InChI:
InChI=1S/C9H11BrO/c10-9-6-2-1-4-8(9)5-3-7-11/h1-2,4,6,11H,3,5,7H2
InChI Key:
VODAJGPTULSNSU-UHFFFAOYSA-N
SMILES:
OCCCc1ccccc1Br

Properties

Complexity:
106  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.999g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.09g/mol
Monoisotopic Mass:
213.999g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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