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2059993-87-0 | 5-[(2-iodoethoxy)methyl]-4-methyl-1H-1,2,3-triazole
CAS No: 2059993-87-0 Catalog No: AG01BVZM MDL No:MFCD30476630
Product Description
Catalog Number:
AG01BVZM
Chemical Name:
5-[(2-iodoethoxy)methyl]-4-methyl-1H-1,2,3-triazole
CAS Number:
2059993-87-0
Molecular Formula:
C6H10IN3O
Molecular Weight:
267.0676
MDL Number:
MFCD30476630
IUPAC Name:
4-(2-iodoethoxymethyl)-5-methyl-2H-triazole
InChI:
InChI=1S/C6H10IN3O/c1-5-6(9-10-8-5)4-11-3-2-7/h2-4H2,1H3,(H,8,9,10)
InChI Key:
ATSOKWMONOLEBX-UHFFFAOYSA-N
SMILES:
ICCOCc1[nH]nnc1C
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.987g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.07g/mol
Monoisotopic Mass:
266.987g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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