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1015845-81-4 | 1H-Pyrazole-4-methanamine, 1-ethyl-N-(2-methoxyethyl)-
CAS No: 1015845-81-4 Catalog No: AG0004V6 MDL No:MFCD08691495
Product Description
Catalog Number:
AG0004V6
Chemical Name:
1H-Pyrazole-4-methanamine, 1-ethyl-N-(2-methoxyethyl)-
CAS Number:
1015845-81-4
Molecular Formula:
C9H17N3O
Molecular Weight:
183.2508
MDL Number:
MFCD08691495
IUPAC Name:
N-[(1-ethylpyrazol-4-yl)methyl]-2-methoxyethanamine
InChI:
InChI=1S/C9H17N3O/c1-3-12-8-9(7-11-12)6-10-4-5-13-2/h7-8,10H,3-6H2,1-2H3
InChI Key:
LHQXRLQFAAWQHE-UHFFFAOYSA-N
SMILES:
COCCNCc1cnn(c1)CC
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.137g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.255g/mol
Monoisotopic Mass:
183.137g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
39.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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