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177217-27-5

177217-27-5 | Benzene, 1-bromo-4-(hexyloxy)-2,5-dimethyl-

CAS No: 177217-27-5 Catalog No: AG00256A MDL No:

Product Description

Catalog Number:
AG00256A
Chemical Name:
Benzene, 1-bromo-4-(hexyloxy)-2,5-dimethyl-
CAS Number:
177217-27-5
Molecular Formula:
C14H21BrO
Molecular Weight:
285.2199
IUPAC Name:
1-bromo-4-hexoxy-2,5-dimethylbenzene
InChI:
InChI=1S/C14H21BrO/c1-4-5-6-7-8-16-14-10-11(2)13(15)9-12(14)3/h9-10H,4-8H2,1-3H3
InChI Key:
IRMSAHMJNRFTOT-UHFFFAOYSA-N
SMILES:
Cc1cc(Br)c(cc1OCCCCCC)C

Properties

Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.078g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.225g/mol
Monoisotopic Mass:
284.078g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6  

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