Home Other Building Blocks 2-(2H-1,3-benzodioxol-5-yl)-2-methylpropan-1-amine

2-(2H-1,3-benzodioxol-5-yl)-2-methylpropan-1-amine

CAS No.:
23131-47-7
Catalog Number:
AG01A7VS
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
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Product Description
Catalog Number:
AG01A7VS
Chemical Name:
2-(2H-1,3-benzodioxol-5-yl)-2-methylpropan-1-amine
CAS Number:
23131-47-7
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
MDL Number:
MFCD12774756
IUPAC Name:
2-(1,3-benzodioxol-5-yl)-2-methylpropan-1-amine
InChI:
InChI=1S/C11H15NO2/c1-11(2,6-12)8-3-4-9-10(5-8)14-7-13-9/h3-5H,6-7,12H2,1-2H3
InChI Key:
CGZCCWRCOLWZKV-UHFFFAOYSA-N
SMILES:
NCC(c1ccc2c(c1)OCO2)(C)C
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.11g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties