Home Halogens (2-bromopropan-2-yl)benzene

(2-bromopropan-2-yl)benzene

CAS No.:
3575-19-7
Catalog Number:
AG01ELXV
Molecular Formula:
C9H11Br
Molecular Weight:
199.0876
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Product Description
Catalog Number:
AG01ELXV
Chemical Name:
(2-bromopropan-2-yl)benzene
CAS Number:
3575-19-7
Molecular Formula:
C9H11Br
Molecular Weight:
199.0876
MDL Number:
MFCD10698752
IUPAC Name:
2-bromopropan-2-ylbenzene
InChI:
InChI=1S/C9H11Br/c1-9(2,10)8-6-4-3-5-7-8/h3-7H,1-2H3
InChI Key:
WSFSJXBURLJOFD-UHFFFAOYSA-N
SMILES:
CC(c1ccccc1)(Br)C
Properties
Complexity:
101  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.004g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.091g/mol
Monoisotopic Mass:
198.004g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties