Home Other Building Blocks 4-METHYL-3-(OXAN-4-YL)-1H-PYRAZOL-5-AMINE

4-METHYL-3-(OXAN-4-YL)-1H-PYRAZOL-5-AMINE

CAS No.:
1350477-86-9
Catalog Number:
AG01DVWA
Molecular Formula:
C9H15N3O
Molecular Weight:
181.2349
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Product Description
Catalog Number:
AG01DVWA
Chemical Name:
4-METHYL-3-(OXAN-4-YL)-1H-PYRAZOL-5-AMINE
CAS Number:
1350477-86-9
Molecular Formula:
C9H15N3O
Molecular Weight:
181.2349
MDL Number:
MFCD17243849
IUPAC Name:
4-methyl-5-(oxan-4-yl)-1H-pyrazol-3-amine
InChI:
InChI=1S/C9H15N3O/c1-6-8(11-12-9(6)10)7-2-4-13-5-3-7/h7H,2-5H2,1H3,(H3,10,11,12)
InChI Key:
VBBBTQSQJTVDDF-UHFFFAOYSA-N
SMILES:
Cc1c(n[nH]c1N)C1CCOCC1
Properties
Complexity:
170  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
181.239g/mol
Monoisotopic Mass:
181.122g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties