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1225803-41-7

1225803-41-7 | 1-Bromo-3-chloro-6-n-propyloxybenzene

CAS No: 1225803-41-7 Catalog No: AG01ER3V MDL No:

Product Description

Catalog Number:
AG01ER3V
Chemical Name:
1-Bromo-3-chloro-6-n-propyloxybenzene
CAS Number:
1225803-41-7
Molecular Formula:
C9H10BrClO
Molecular Weight:
249.5321
IUPAC Name:
2-bromo-4-chloro-1-propoxybenzene
InChI:
InChI=1S/C9H10BrClO/c1-2-5-12-9-4-3-7(11)6-8(9)10/h3-4,6H,2,5H2,1H3
InChI Key:
UAGGUWJSPAGVDQ-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1Br)Cl

Properties

Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.96g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.532g/mol
Monoisotopic Mass:
247.96g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  

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