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182634-34-0 | BENZO[1,3]DIOXOL-4-METHYLAMINE
CAS No: 182634-34-0 Catalog No: AG00240W MDL No:MFCD11858181
Product Description
Catalog Number:
AG00240W
Chemical Name:
BENZO[1,3]DIOXOL-4-METHYLAMINE
CAS Number:
182634-34-0
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
MDL Number:
MFCD11858181
IUPAC Name:
1,3-benzodioxol-4-ylmethanamine
InChI:
InChI=1S/C8H9NO2/c9-4-6-2-1-3-7-8(6)11-5-10-7/h1-3H,4-5,9H2
InChI Key:
WOSCKVGRNOPBKO-UHFFFAOYSA-N
SMILES:
NCc1cccc2c1OCO2
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.063g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.165g/mol
Monoisotopic Mass:
151.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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