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87996-15-4 | 1H-Tetrazole, 1-(1,1-dimethylethyl)-5-(4-pentenyloxy)-
CAS No: 87996-15-4 Catalog No: AG004L51 MDL No:
Product Description
Catalog Number:
AG004L51
Chemical Name:
1H-Tetrazole, 1-(1,1-dimethylethyl)-5-(4-pentenyloxy)-
CAS Number:
87996-15-4
Molecular Formula:
C10H18N4O
Molecular Weight:
210.2761
IUPAC Name:
1-tert-butyl-5-pent-4-enoxytetrazole
InChI:
InChI=1S/C10H18N4O/c1-5-6-7-8-15-9-11-12-13-14(9)10(2,3)4/h5H,1,6-8H2,2-4H3
InChI Key:
YPEZOUADTSQZLY-UHFFFAOYSA-N
SMILES:
C=CCCCOc1nnnn1C(C)(C)C
Properties
Complexity:
202
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:
0
Isotope Atom Count:
0
Molecular Weight:
210.281g/mol
Monoisotopic Mass:
210.148g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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