Home Halogens 1-(1-bromoethyl)-4-(difluoromethoxy)benzene

1-(1-bromoethyl)-4-(difluoromethoxy)benzene

CAS No.:
1094363-83-3
Catalog Number:
AG01AJLJ
Molecular Formula:
C9H9BrF2O
Molecular Weight:
251.0680
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Product Description
Catalog Number:
AG01AJLJ
Chemical Name:
1-(1-bromoethyl)-4-(difluoromethoxy)benzene
CAS Number:
1094363-83-3
Molecular Formula:
C9H9BrF2O
Molecular Weight:
251.0680
MDL Number:
MFCD11185335
IUPAC Name:
1-(1-bromoethyl)-4-(difluoromethoxy)benzene
InChI:
InChI=1S/C9H9BrF2O/c1-6(10)7-2-4-8(5-3-7)13-9(11)12/h2-6,9H,1H3
InChI Key:
ZXVUIFFRJULZMX-UHFFFAOYSA-N
SMILES:
FC(Oc1ccc(cc1)C(Br)C)F
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.98g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.071g/mol
Monoisotopic Mass:
249.98g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties