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91571-00-5

91571-00-5 | Naphthalene, 1-(bromomethyl)-2-methoxy-

CAS No: 91571-00-5 Catalog No: AG01FCHJ MDL No:

Product Description

Catalog Number:
AG01FCHJ
Chemical Name:
Naphthalene, 1-(bromomethyl)-2-methoxy-
CAS Number:
91571-00-5
Molecular Formula:
C12H11BrO
Molecular Weight:
251.1191
IUPAC Name:
1-(bromomethyl)-2-methoxynaphthalene
InChI:
InChI=1S/C12H11BrO/c1-14-12-7-6-9-4-2-3-5-10(9)11(12)8-13/h2-7H,8H2,1H3
InChI Key:
FITUXDWDCPOBIX-UHFFFAOYSA-N
SMILES:
BrCc1c(OC)ccc2c1cccc2

Properties

Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.999g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.123g/mol
Monoisotopic Mass:
249.999g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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