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32953-14-3 | N-Ethylbenzo[d][1,3]dioxol-5-amine
CAS No: 32953-14-3 Catalog No: AG003SZO MDL No:MFCD00009743
Product Description
Catalog Number:
AG003SZO
Chemical Name:
N-Ethylbenzo[d][1,3]dioxol-5-amine
CAS Number:
32953-14-3
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
MDL Number:
MFCD00009743
IUPAC Name:
N-ethyl-1,3-benzodioxol-5-amine
InChI:
InChI=1S/C9H11NO2/c1-2-10-7-3-4-8-9(5-7)12-6-11-8/h3-5,10H,2,6H2,1H3
InChI Key:
FPKGTVXPIULTIP-UHFFFAOYSA-N
SMILES:
CCNc1ccc2c(c1)OCO2
EC Number:
251-302-6
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:
2
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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