cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol

C10H20CoF3NO — CID 169074081

IUPACcobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol
SMILESCC(C)N(CC(O)CC(F)(F)F)C(C)C.[Co]
InChIInChI=1S/C10H20F3NO.Co/c1-7(2)14(8(3)4)6-9(15)5-10(11,12)13;/h7-9,15H,5-6H2,1-4H3;
InChIKeyFXWXYLCXUDNASK-UHFFFAOYSA-N
MW286.20 g/mol
LogP2.42
Rot. Bonds5

About cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol

cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol (PubChem CID 169074081) has the molecular formula C10H20CoF3NO and a molecular weight of 286.20 g/mol. Its IUPAC name is cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol.

Molecular Properties

Compound Namecobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol
PubChem CID169074081
Molecular FormulaC10H20CoF3NO
Molecular Weight286.20 g/mol
Exact Mass286.08
IUPAC Namecobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol
SMILESCC(C)N(CC(O)CC(F)(F)F)C(C)C.[Co]
InChIInChI=1S/C10H20F3NO.Co/c1-7(2)14(8(3)4)6-9(15)5-10(11,12)13;/h7-9,15H,5-6H2,1-4H3;
InChIKeyFXWXYLCXUDNASK-UHFFFAOYSA-N
XLogP2.42
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.20
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1,1,1-trifluoropentan-3-ol
CID 170602798
(3S)-1,1,1-trifluoro-5-sulfanylhexan-3-ol
CID 162604616
1,1,1-trifluorohept-5-yn-3-ol
CID 62311577
copper;4-(dimethylamino)-1,1,1-trifluoropentan-3-ol
CID 169074035
1,1,1-trifluoro-5-methyloctan-3-ol
CID 62607846
1-(dimethylamino)-4,4,5,5,6,6,7,7,7-nonafluoroheptan-2-ol
CID 138396345
1,1,1-trifluoro-3-methylpentane
CID 21020397
1,1,1-trifluorododecan-3-ol
CID 62606550
2-[[di(propan-2-yl)amino]methyl]-1,1,1,4,4,4-hexafluorobutan-2-ol
CID 169074064
1,1,2,2,3,3,4,4,4-nonafluoro-N-[2-hydroxy-3-[methyl(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)amino]propyl]-N-methylbutane-1-sulfonamide
CID 131726187
1,1,1-trifluorohept-6-yn-3-ol
CID 63657299
2,2,3,3,3-pentafluoro-N,N-di(propan-2-yl)propan-1-amine
CID 11806562

Frequently Asked Questions

What is the IUPAC name of cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol?
The IUPAC name of cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol (CID 169074081) is cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol.
What is the SMILES notation for cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol?
The canonical SMILES for cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol is CC(C)N(CC(O)CC(F)(F)F)C(C)C.[Co].
What is the InChIKey of cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol?
The InChIKey is FXWXYLCXUDNASK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F3NO.Co/c1-7(2)14(8(3)4)6-9(15)5-10(11,12)13;/h7-9,15H,5-6H2,1-4H3;.
What are the key properties of cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol?
cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol has a molecular weight of 286.20 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;1-[di(propan-2-yl)amino]-4,4,4-trifluorobutan-2-ol is sourced from PubChem (CID 169074081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).