1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol

C104H241F2NO14 — CID 167706719

About 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol

1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol (PubChem CID 167706719) has the molecular formula C104H241F2NO14 and a molecular weight of 1768.06 g/mol. Its IUPAC name is 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol.

Molecular Properties

• Compound Name: 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol
• PubChem CID: 167706719
• Molecular Formula: C104H241F2NO14
• Molecular Weight: 1768.06 g/mol
• Exact Mass: 1766.81
• IUPAC Name: 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol
• SMILES: C=CC(C)C.CC(=O)C(C)C.CC(C)C.CC(C)C.CC(C)C(=O)O.CC(C)C(C)(C)O.CC(C)C(C)C.CC(C)C(C)O.CC(C)C(F)F.CC(C)CN.CC(C)CO.CC(C)O.CCC(C)C.CCCC(C)C.CCCC(C)C.COC(=O)C(C)C.COC(C)(C)C(C)C.COC(C)C.COC(C)C(C)C.COCC(C)C.COCCC(C)C
• InChI: InChI=1S/C7H16O.3C6H14O.3C6H14.C5H10O2.2C5H12O.C5H10O.C5H12.C5H10.C4H8F2.C4H11N.C4H8O2.2C4H10O.2C4H10.C3H8O/c1-6(2)7(3,4)8-5;1-6(2)4-5-7-3;1-5(2)6(3)7-4;1-5(2)6(3,4)7;1-5(2)6(3)4;2*1-4-5-6(2)3;1-4(2)5(6)7-3;1-5(2)4-6-3;2*1-4(2)5(3)6;2*1-4-5(2)3;1-3(2)4(5)6;1-4(2)3-5;1-3(2)4(5)6;1-4(2)5-3;1-4(2)3-5;2*1-4(2)3;1-3(2)4/h6H,1-5H3;6H,4-5H2,1-3H3;5-6H,1-4H3;5,7H,1-4H3;5-6H,1-4H3;2*6H,4-5H2,1-3H3;4H,1-3H3;5H,4H2,1-3H3;4-6H,1-3H3;4H,1-3H3;5H,4H2,1-3H3;4-5H,1H2,2-3H3;3-4H,1-2H3;4H,3,5H2,1-2H3;3H,1-2H3,(H,5,6);4H,1-3H3;4-5H,3H2,1-2H3;2*4H,1-3H3;3-4H,1-2H3
• InChIKey: ZEXMAMUPCRTDRR-UHFFFAOYSA-N
• XLogP: 30.88
• TPSA: 233.76 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 14
• Rotatable Bonds: 25
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1768.06
LogP ≤ 5	30.88
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol?

The IUPAC name of 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol (CID 167706719) is 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol.

What is the SMILES notation for 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol?

The canonical SMILES for 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol is C=CC(C)C.CC(=O)C(C)C.CC(C)C.CC(C)C.CC(C)C(=O)O.CC(C)C(C)(C)O.CC(C)C(C)C.CC(C)C(C)O.CC(C)C(F)F.CC(C)CN.CC(C)CO.CC(C)O.CCC(C)C.CCCC(C)C.CCCC(C)C.COC(=O)C(C)C.COC(C)(C)C(C)C.COC(C)C.COC(C)C(C)C.COCC(C)C.COCCC(C)C.

What is the InChIKey of 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol?

The InChIKey is ZEXMAMUPCRTDRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O.3C6H14O.3C6H14.C5H10O2.2C5H12O.C5H10O.C5H12.C5H10.C4H8F2.C4H11N.C4H8O2.2C4H10O.2C4H10.C3H8O/c1-6(2)7(3,4)8-5;1-6(2)4-5-7-3;1-5(2)6(3)7-4;1-5(2)6(3,4)7;1-5(2)6(3)4;2*1-4-5-6(2)3;1-4(2)5(6)7-3;1-5(2)4-6-3;2*1-4(2)5(3)6;2*1-4-5(2)3;1-3(2)4(5)6;1-4(2)3-5;1-3(2)4(5)6;1-4(2)5-3;1-4(2)3-5;2*1-4(2)3;1-3(2)4/h6H,1-5H3;6H,4-5H2,1-3H3;5-6H,1-4H3;5,7H,1-4H3;5-6H,1-4H3;2*6H,4-5H2,1-3H3;4H,1-3H3;5H,4H2,1-3H3;4-6H,1-3H3;4H,1-3H3;5H,4H2,1-3H3;4-5H,1H2,2-3H3;3-4H,1-2H3;4H,3,5H2,1-2H3;3H,1-2H3,(H,5,6);4H,1-3H3;4-5H,3H2,1-2H3;2*4H,1-3H3;3-4H,1-2H3.

What are the key properties of 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol?

1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol has a molecular weight of 1768.06 g/mol, XLogP of 30.88, 25 rotatable bonds, 6 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 1,1-difluoro-2-methylpropane;2,3-dimethylbutane;2,3-dimethylbutan-2-ol;2-methoxy-2,3-dimethylbutane;1-methoxy-3-methylbutane;2-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methoxypropane;2-methylbutane;3-methylbutan-2-ol;3-methylbutan-2-one;3-methylbut-1-ene;methyl 2-methylpropanoate;bis(2-methylpentane);2-methylpropan-1-amine;bis(2-methylpropane);2-methylpropanoic acid;2-methylpropan-1-ol;propan-2-ol is sourced from PubChem (CID 167706719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).