Home Other Building Blocks 1-(3,3-diethoxypropyl)-1H-1,2,4-triazole

1-(3,3-diethoxypropyl)-1H-1,2,4-triazole

CAS No.:
1341430-62-3
Catalog Number:
AG019T5T
Molecular Formula:
C9H17N3O2
Molecular Weight:
199.2502
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Product Description
Catalog Number:
AG019T5T
Chemical Name:
1-(3,3-diethoxypropyl)-1H-1,2,4-triazole
CAS Number:
1341430-62-3
Molecular Formula:
C9H17N3O2
Molecular Weight:
199.2502
IUPAC Name:
1-(3,3-diethoxypropyl)-1,2,4-triazole
InChI:
InChI=1S/C9H17N3O2/c1-3-13-9(14-4-2)5-6-12-8-10-7-11-12/h7-9H,3-6H2,1-2H3
InChI Key:
DTPLJOQKEKBFBM-UHFFFAOYSA-N
SMILES:
CCOC(OCC)CCn1ncnc1
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.132g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.254g/mol
Monoisotopic Mass:
199.132g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties