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17413-10-4 | 1,4-Benzodioxin-6-methanamine, 2,3-dihydro-
CAS No: 17413-10-4 Catalog No: AG001ZHJ MDL No:MFCD02677684
Product Description
Catalog Number:
AG001ZHJ
Chemical Name:
1,4-Benzodioxin-6-methanamine, 2,3-dihydro-
CAS Number:
17413-10-4
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
MDL Number:
MFCD02677684
IUPAC Name:
2,3-dihydro-1,4-benzodioxin-6-ylmethanamine
InChI:
InChI=1S/C9H11NO2/c10-6-7-1-2-8-9(5-7)12-4-3-11-8/h1-2,5H,3-4,6,10H2
InChI Key:
FUDYRLUSXBRPIA-UHFFFAOYSA-N
SMILES:
NCc1ccc2c(c1)OCCO2
EC Number:
241-440-5
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.192g/mol
Monoisotopic Mass:
165.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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