Home Other Building Blocks [2-(1-ethyl-1H-pyrazol-5-yl)oxolan-3-yl]methanamine, trans

[2-(1-ethyl-1H-pyrazol-5-yl)oxolan-3-yl]methanamine, trans

CAS No.:
1808068-45-2
Catalog Number:
AG01AGFC
Molecular Formula:
C10H17N3O
Molecular Weight:
195.2615
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Product Description
Catalog Number:
AG01AGFC
Chemical Name:
[2-(1-ethyl-1H-pyrazol-5-yl)oxolan-3-yl]methanamine, trans
CAS Number:
1808068-45-2
Molecular Formula:
C10H17N3O
Molecular Weight:
195.2615
MDL Number:
MFCD29047444
IUPAC Name:
[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxolan-3-yl]methanamine
InChI:
InChI=1S/C10H17N3O/c1-2-13-9(3-5-12-13)10-8(7-11)4-6-14-10/h3,5,8,10H,2,4,6-7,11H2,1H3/t8-,10+/m0/s1
InChI Key:
DLWWPQSCTUCBBK-WCBMZHEXSA-N
SMILES:
NC[C@@H]1CCO[C@H]1c1ccnn1CC
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
195.137g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.266g/mol
Monoisotopic Mass:
195.137g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties