Home Halogens (1-bromo-2-methoxypropan-2-yl)benzene

(1-bromo-2-methoxypropan-2-yl)benzene

CAS No.:
126990-14-5
Catalog Number:
AG01AP0V
Molecular Formula:
C10H13BrO
Molecular Weight:
229.1136
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Product Description
Catalog Number:
AG01AP0V
Chemical Name:
(1-bromo-2-methoxypropan-2-yl)benzene
CAS Number:
126990-14-5
Molecular Formula:
C10H13BrO
Molecular Weight:
229.1136
MDL Number:
MFCD00517652
IUPAC Name:
(1-bromo-2-methoxypropan-2-yl)benzene
InChI:
InChI=1S/C10H13BrO/c1-10(8-11,12-2)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChI Key:
VFOYFMNCGSJADN-UHFFFAOYSA-N
SMILES:
BrCC(c1ccccc1)(OC)C
Properties
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.015g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.117g/mol
Monoisotopic Mass:
228.015g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties