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13686-49-2

13686-49-2 | Naphthalene, 1-(2-bromoethyl)-

CAS No: 13686-49-2 Catalog No: AG0012HP MDL No:MFCD00037737

Product Description

Catalog Number:
AG0012HP
Chemical Name:
Naphthalene, 1-(2-bromoethyl)-
CAS Number:
13686-49-2
Molecular Formula:
C12H11Br
Molecular Weight:
235.1197
MDL Number:
MFCD00037737
IUPAC Name:
1-(2-bromoethyl)naphthalene
InChI:
InChI=1S/C12H11Br/c13-9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7H,8-9H2
InChI Key:
GPHCPUFIWQJZOI-UHFFFAOYSA-N
SMILES:
BrCCc1cccc2c1cccc2

Properties

Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.004g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.124g/mol
Monoisotopic Mass:
234.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  

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