Home Other Building Blocks 4-(1,3-dioxaindan-5-yl)butan-1-ol

4-(1,3-dioxaindan-5-yl)butan-1-ol

CAS No.:
97664-49-8
Catalog Number:
AG01EMHZ
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
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Product Description
Catalog Number:
AG01EMHZ
Chemical Name:
4-(1,3-dioxaindan-5-yl)butan-1-ol
CAS Number:
97664-49-8
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
MDL Number:
MFCD14529794
IUPAC Name:
4-(1,3-benzodioxol-5-yl)butan-1-ol
InChI:
InChI=1S/C11H14O3/c12-6-2-1-3-9-4-5-10-11(7-9)14-8-13-10/h4-5,7,12H,1-3,6,8H2
InChI Key:
KFJKMUYYBNBSMT-UHFFFAOYSA-N
SMILES:
OCCCCc1ccc2c(c1)OCO2
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties