Home Other Building Blocks [2-(1-methyl-1H-pyrazol-4-yl)oxolan-2-yl]methanamine

[2-(1-methyl-1H-pyrazol-4-yl)oxolan-2-yl]methanamine

CAS No.:
2138279-02-2
Catalog Number:
AG01EJL2
Molecular Formula:
C9H15N3O
Molecular Weight:
181.2349
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Product Description
Catalog Number:
AG01EJL2
Chemical Name:
[2-(1-methyl-1H-pyrazol-4-yl)oxolan-2-yl]methanamine
CAS Number:
2138279-02-2
Molecular Formula:
C9H15N3O
Molecular Weight:
181.2349
MDL Number:
MFCD31456946
IUPAC Name:
[2-(1-methylpyrazol-4-yl)oxolan-2-yl]methanamine
InChI:
InChI=1S/C9H15N3O/c1-12-6-8(5-11-12)9(7-10)3-2-4-13-9/h5-6H,2-4,7,10H2,1H3
InChI Key:
YPJOOPMYFLEHFQ-UHFFFAOYSA-N
SMILES:
NCC1(CCCO1)c1cnn(c1)C
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.122g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.239g/mol
Monoisotopic Mass:
181.122g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties