Home Other Building Blocks 2-(3-ethyl-1H-1,2,4-triazol-5-yl)morpholine

2-(3-ethyl-1H-1,2,4-triazol-5-yl)morpholine

CAS No.:
1251080-78-0
Catalog Number:
AG019SLR
Molecular Formula:
C8H14N4O
Molecular Weight:
182.2230
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Product Description
Catalog Number:
AG019SLR
Chemical Name:
2-(3-ethyl-1H-1,2,4-triazol-5-yl)morpholine
CAS Number:
1251080-78-0
Molecular Formula:
C8H14N4O
Molecular Weight:
182.2230
MDL Number:
MFCD22378803
IUPAC Name:
2-(5-ethyl-1H-1,2,4-triazol-3-yl)morpholine
InChI:
InChI=1S/C8H14N4O/c1-2-7-10-8(12-11-7)6-5-9-3-4-13-6/h6,9H,2-5H2,1H3,(H,10,11,12)
InChI Key:
RUOBZLJWEMZMRP-UHFFFAOYSA-N
SMILES:
CCc1nc([nH]n1)C1CNCCO1
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.117g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
182.227g/mol
Monoisotopic Mass:
182.117g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties