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19997-48-9

19997-48-9 | Benzofuran, 2-(bromomethyl)-2,3-dihydro-5-methyl-

CAS No: 19997-48-9 Catalog No: AG002CH8 MDL No:MFCD00086223

Product Description

Catalog Number:
AG002CH8
Chemical Name:
Benzofuran, 2-(bromomethyl)-2,3-dihydro-5-methyl-
CAS Number:
19997-48-9
Molecular Formula:
C10H11BrO
Molecular Weight:
227.0977
MDL Number:
MFCD00086223
IUPAC Name:
2-(bromomethyl)-5-methyl-2,3-dihydro-1-benzofuran
InChI:
InChI=1S/C10H11BrO/c1-7-2-3-10-8(4-7)5-9(6-11)12-10/h2-4,9H,5-6H2,1H3
InChI Key:
KUDMJKVKBRFFND-UHFFFAOYSA-N
SMILES:
BrCC1Cc2c(O1)ccc(c2)C
EC Number:
243-456-8
NSC Number:
118099

Properties

Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.999g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.101g/mol
Monoisotopic Mass:
225.999g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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