Home Other Building Blocks 2-(3,4-DIHYDRO-1H-2-BENZOPYRAN-6-YL)ACETIC ACID

2-(3,4-DIHYDRO-1H-2-BENZOPYRAN-6-YL)ACETIC ACID

CAS No.:
933694-72-5
Catalog Number:
AG01DWVM
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
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Product Description
Catalog Number:
AG01DWVM
Chemical Name:
2-(3,4-DIHYDRO-1H-2-BENZOPYRAN-6-YL)ACETIC ACID
CAS Number:
933694-72-5
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
MDL Number:
MFCD18416363
IUPAC Name:
2-(3,4-dihydro-1H-isochromen-6-yl)acetic acid
InChI:
InChI=1S/C11H12O3/c12-11(13)6-8-1-2-10-7-14-4-3-9(10)5-8/h1-2,5H,3-4,6-7H2,(H,12,13)
InChI Key:
KUNHLNVWMBYHJZ-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc2c(c1)CCOC2
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.214g/mol
Monoisotopic Mass:
192.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties