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188955-55-7 | 2-Propenoic acid, 2-(bromomethyl)-, 1-methylethyl ester
CAS No: 188955-55-7 Catalog No: AG002HKV MDL No:
Product Description
Catalog Number:
AG002HKV
Chemical Name:
2-Propenoic acid, 2-(bromomethyl)-, 1-methylethyl ester
CAS Number:
188955-55-7
Molecular Formula:
C7H11BrO2
Molecular Weight:
207.0650
IUPAC Name:
propan-2-yl 2-(bromomethyl)prop-2-enoate
InChI:
InChI=1S/C7H11BrO2/c1-5(2)10-7(9)6(3)4-8/h5H,3-4H2,1-2H3
InChI Key:
SLOJILWLCXWQSY-UHFFFAOYSA-N
SMILES:
BrCC(=C)C(=O)OC(C)C
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.994g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.067g/mol
Monoisotopic Mass:
205.994g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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