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141819-15-0 | 1-(4-Bromophenyl)-2-pentanol
CAS No: 141819-15-0 Catalog No: AG01ETT8 MDL No:
Product Description
Catalog Number:
AG01ETT8
Chemical Name:
1-(4-Bromophenyl)-2-pentanol
CAS Number:
141819-15-0
Molecular Formula:
C11H15BrO
Molecular Weight:
243.1402
IUPAC Name:
1-(4-bromophenyl)pentan-2-ol
InChI:
InChI=1S/C11H15BrO/c1-2-3-11(13)8-9-4-6-10(12)7-5-9/h4-7,11,13H,2-3,8H2,1H3
InChI Key:
FEADPIQNTBCKOB-UHFFFAOYSA-N
SMILES:
CCCC(Cc1ccc(cc1)Br)O
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.031g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.144g/mol
Monoisotopic Mass:
242.031g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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