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1015845-60-9 | 1H-Pyrazole-4-methanamine, N-(2-methoxyethyl)-1-methyl-
CAS No: 1015845-60-9 Catalog No: AG0004VK MDL No:MFCD08691494
Product Description
Catalog Number:
AG0004VK
Chemical Name:
1H-Pyrazole-4-methanamine, N-(2-methoxyethyl)-1-methyl-
CAS Number:
1015845-60-9
Molecular Formula:
C8H15N3O
Molecular Weight:
169.2242
MDL Number:
MFCD08691494
IUPAC Name:
2-methoxy-N-[(1-methylpyrazol-4-yl)methyl]ethanamine
InChI:
InChI=1S/C8H15N3O/c1-11-7-8(6-10-11)5-9-3-4-12-2/h6-7,9H,3-5H2,1-2H3
InChI Key:
QTJBDRHCCNCVDW-UHFFFAOYSA-N
SMILES:
COCCNCc1cnn(c1)C
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.122g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.228g/mol
Monoisotopic Mass:
169.122g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
39.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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