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145284-65-7 | 1,3-Benzodioxol-5-ol, 6-(2-aminopropyl)-
CAS No: 145284-65-7 Catalog No: AG001KQP MDL No:
Product Description
Catalog Number:
AG001KQP
Chemical Name:
1,3-Benzodioxol-5-ol, 6-(2-aminopropyl)-
CAS Number:
145284-65-7
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
IUPAC Name:
6-(2-aminopropyl)-1,3-benzodioxol-5-ol
InChI:
InChI=1S/C10H13NO3/c1-6(11)2-7-3-9-10(4-8(7)12)14-5-13-9/h3-4,6,12H,2,5,11H2,1H3
InChI Key:
ZSQKQWSGSMXANC-UHFFFAOYSA-N
SMILES:
CC(Cc1cc2OCOc2cc1O)N
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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