Home Other Building Blocks 4-(1,3-dioxolan-2-yl)benzoic acid

4-(1,3-dioxolan-2-yl)benzoic acid

CAS No.:
35849-02-6
Catalog Number:
AG01C4A7
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
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Product Description
Catalog Number:
AG01C4A7
Chemical Name:
4-(1,3-dioxolan-2-yl)benzoic acid
CAS Number:
35849-02-6
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
MDL Number:
MFCD06208987
IUPAC Name:
4-(1,3-dioxolan-2-yl)benzoic acid
InChI:
InChI=1S/C10H10O4/c11-9(12)7-1-3-8(4-2-7)10-13-5-6-14-10/h1-4,10H,5-6H2,(H,11,12)
InChI Key:
NTQFLFYOFQFWPM-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)C1OCCO1
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.186g/mol
Monoisotopic Mass:
194.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties