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24886-62-2 | 1H-Tetrazole, 5-methyl-1-tricyclo[3.3.1.13,7]dec-1-yl-
CAS No: 24886-62-2 Catalog No: AG002PR1 MDL No:
Product Description
Catalog Number:
AG002PR1
Chemical Name:
1H-Tetrazole, 5-methyl-1-tricyclo[3.3.1.13,7]dec-1-yl-
CAS Number:
24886-62-2
Molecular Formula:
C12H18N4
Molecular Weight:
218.2981
IUPAC Name:
1-(1-adamantyl)-5-methyltetrazole
InChI:
InChI=1S/C12H18N4/c1-8-13-14-15-16(8)12-5-9-2-10(6-12)4-11(3-9)7-12/h9-11H,2-7H2,1H3
InChI Key:
UQVSTUMZYIFLBP-UHFFFAOYSA-N
SMILES:
Cc1nnnn1C12CC3CC(C2)CC(C1)C3
UNII:
RS9AZ64Q01
NSC Number:
140704
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.153g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.304g/mol
Monoisotopic Mass:
218.153g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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