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

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

CAS No.:
1384428-59-4
Catalog Number:
AG01EHUG
Molecular Formula:
C10H18N4O
Molecular Weight:
210.2761
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Product Description
Catalog Number:
AG01EHUG
Chemical Name:
2-(3-tert-butyl-1H-1,2,4-triazol-5-yl)morpholine
CAS Number:
1384428-59-4
Molecular Formula:
C10H18N4O
Molecular Weight:
210.2761
MDL Number:
MFCD22196678
IUPAC Name:
2-(3-tert-butyl-1H-1,2,4-triazol-5-yl)morpholine
InChI:
InChI=1S/C10H18N4O/c1-10(2,3)9-12-8(13-14-9)7-6-11-4-5-15-7/h7,11H,4-6H2,1-3H3,(H,12,13,14)
InChI Key:
IRRRCRKDFMWWNV-UHFFFAOYSA-N
SMILES:
CC(c1nc([nH]n1)C1OCCNC1)(C)C
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.148g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
210.281g/mol
Monoisotopic Mass:
210.148g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties