Home Halogens 1,3-dimethyl 2-(2-bromopropan-2-yl)propanedioate

1,3-dimethyl 2-(2-bromopropan-2-yl)propanedioate

CAS No.:
1803587-63-4
Catalog Number:
AG01BGYO
Molecular Formula:
C8H13BrO4
Molecular Weight:
253.0904
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Product Description
Catalog Number:
AG01BGYO
Chemical Name:
1,3-dimethyl 2-(2-bromopropan-2-yl)propanedioate
CAS Number:
1803587-63-4
Molecular Formula:
C8H13BrO4
Molecular Weight:
253.0904
MDL Number:
MFCD28383717
IUPAC Name:
dimethyl 2-(2-bromopropan-2-yl)propanedioate
InChI:
InChI=1S/C8H13BrO4/c1-8(2,9)5(6(10)12-3)7(11)13-4/h5H,1-4H3
InChI Key:
OSIQYKGFQWQFLO-UHFFFAOYSA-N
SMILES:
COC(=O)C(C(Br)(C)C)C(=O)OC
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.092g/mol
Monoisotopic Mass:
252g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties