sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 2H-1-Benzopyran-3(4H)-one

2H-1-Benzopyran-3(4H)-one

CAS No.:
19090-04-1
Catalog Number:
AG002EWX
Molecular Formula:
C9H8O2
Molecular Weight:
148.1586
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG002EWX
Chemical Name:
2H-1-Benzopyran-3(4H)-one
CAS Number:
19090-04-1
Molecular Formula:
C9H8O2
Molecular Weight:
148.1586
MDL Number:
MFCD09996937
IUPAC Name:
4H-chromen-3-one
InChI:
InChI=1S/C9H8O2/c10-8-5-7-3-1-2-4-9(7)11-6-8/h1-4H,5-6H2
InChI Key:
SHHLMGCHMMCOOS-UHFFFAOYSA-N
SMILES:
O=C1COc2c(C1)cccc2
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.052g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.161g/mol
Monoisotopic Mass:
148.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Bacterial degradation of aromatic compounds. International journal of environmental research and public health 20090101
Properties