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60514-36-5 | 1-Bromo-2-n-propyloxynaphthalene
CAS No: 60514-36-5 Catalog No: AG01EWM8 MDL No:
Product Description
Catalog Number:
AG01EWM8
Chemical Name:
1-Bromo-2-n-propyloxynaphthalene
CAS Number:
60514-36-5
Molecular Formula:
C13H13BrO
Molecular Weight:
265.1457
IUPAC Name:
1-bromo-2-propoxynaphthalene
InChI:
InChI=1S/C13H13BrO/c1-2-9-15-12-8-7-10-5-3-4-6-11(10)13(12)14/h3-8H,2,9H2,1H3
InChI Key:
PQLPIFXYQAQUPW-UHFFFAOYSA-N
SMILES:
CCCOc1ccc2c(c1Br)cccc2
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.015g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.15g/mol
Monoisotopic Mass:
264.015g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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