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88112-04-3

88112-04-3 | 3-Benzofuranol, 5-chloro-2,3-dihydro-3-methyl-

CAS No: 88112-04-3 Catalog No: AG004G27 MDL No:

Product Description

Catalog Number:
AG004G27
Chemical Name:
3-Benzofuranol, 5-chloro-2,3-dihydro-3-methyl-
CAS Number:
88112-04-3
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
IUPAC Name:
5-chloro-3-methyl-2H-1-benzofuran-3-ol
InChI:
InChI=1S/C9H9ClO2/c1-9(11)5-12-8-3-2-6(10)4-7(8)9/h2-4,11H,5H2,1H3
InChI Key:
JRVZPNIOBQHKAH-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)C(C)(O)CO2

Properties

Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.029g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.619g/mol
Monoisotopic Mass:
184.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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