Home Other Building Blocks 2-CHLORO-1-(2-METHYLFURAN-3-YL)ETHAN-1-ONE

2-CHLORO-1-(2-METHYLFURAN-3-YL)ETHAN-1-ONE

CAS No.:
1543126-21-1
Catalog Number:
AG01DVLC
Molecular Formula:
C7H7ClO2
Molecular Weight:
158.5823
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Product Description
Catalog Number:
AG01DVLC
Chemical Name:
2-CHLORO-1-(2-METHYLFURAN-3-YL)ETHAN-1-ONE
CAS Number:
1543126-21-1
Molecular Formula:
C7H7ClO2
Molecular Weight:
158.5823
MDL Number:
MFCD23844950
IUPAC Name:
2-chloro-1-(2-methylfuran-3-yl)ethanone
InChI:
InChI=1S/C7H7ClO2/c1-5-6(2-3-10-5)7(9)4-8/h2-3H,4H2,1H3
InChI Key:
PMJAYEWPZAQBFC-UHFFFAOYSA-N
SMILES:
Cc1occc1C(=O)CCl
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.013g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.581g/mol
Monoisotopic Mass:
158.013g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties