CCCCCCI
CAS: 638-45-9
Name: 1-iodohexane
SMILES: CCCCCCI

Molecular Processing

Molecular formula
C6H13I
Molecular weight
212.07
Exact mass
212.0062
XLogP
3
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
4
Heavy atoms
7
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
1
Molar refractivity
43.03

Supplementary Information

InChIKey: ANOOTOPTCJRUPK-UHFFFAOYSA-N
Synonyme
1-IODOHEXANE638-45-9Hexyl iodiden-Hexyl iodideHexane, 1-iodo-1-Hexyl iodide1-iodo-n-hexaneDTXSID2049341NSC 9251EINECS 211-339-027F4BFU2DRHexane,1-iodo-NSC-9251DTXCID2029298ANOOTOPTCJRUPK-UHFFFAOYSA-RefChem:433279211-339-0InChI=1/C6H13I/c1-2-3-4-5-6-7/h2-6H2,1H3IODOHEXANE1-iodo-hexaneMFCD0000110225495-92-5n-hexyliodideiodo-hexane6-iodohexane1 -iodohexane1-Hexyl Iodide; 1-Iodo-n-hexane; Hexyl Iodide; NSC 9251; n-Hexyl Iodide;EINECS 247-034-4UNII-27F4BFU2DRn-C6H13I
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