formaldehyde;2-methylpropane

C5H12O — CID 157396277

IUPACformaldehyde;2-methylpropane
SMILESC=O.CC(C)C
InChIInChI=1S/C4H10.CH2O/c1-4(2)3;1-2/h4H,1-3H3;1H2
InChIKeyBMPKBZXSDATYJY-UHFFFAOYSA-N
MW88.15 g/mol
LogP1.48
Rot. Bonds

About formaldehyde;2-methylpropane

formaldehyde;2-methylpropane (PubChem CID 157396277) has the molecular formula C5H12O and a molecular weight of 88.15 g/mol. Its IUPAC name is formaldehyde;2-methylpropane.

Molecular Properties

Compound Nameformaldehyde;2-methylpropane
PubChem CID157396277
Molecular FormulaC5H12O
Molecular Weight88.15 g/mol
Exact Mass88.09
IUPAC Nameformaldehyde;2-methylpropane
SMILESC=O.CC(C)C
InChIInChI=1S/C4H10.CH2O/c1-4(2)3;1-2/h4H,1-3H3;1H2
InChIKeyBMPKBZXSDATYJY-UHFFFAOYSA-N
XLogP1.48
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.15
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

acetaldehyde;formaldehyde;2-methylpropane
CID 157456500
formaldehyde;2-methylpropane;propan-2-one
CID 157476549
2-methyl(213C)propane
CID 11240418
chromium;2-methylpropane
CID 160648898
2-methylpropane;tungsten
CID 144526928
bis(2-methylpropane);dihydrochloride
CID 174914375
2-methylpropane;stibane
CID 173183868
CID 171375193
CID 171375193
argon;2-methylpropane
CID 158681333
ethane;tetrakis(2-methylpropane)
CID 160890290
helium;2-methylpropane
CID 55222024
2-methylpropane;sulfane
CID 20976886

Frequently Asked Questions

What is the IUPAC name of formaldehyde;2-methylpropane?
The IUPAC name of formaldehyde;2-methylpropane (CID 157396277) is formaldehyde;2-methylpropane.
What is the SMILES notation for formaldehyde;2-methylpropane?
The canonical SMILES for formaldehyde;2-methylpropane is C=O.CC(C)C.
What is the InChIKey of formaldehyde;2-methylpropane?
The InChIKey is BMPKBZXSDATYJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10.CH2O/c1-4(2)3;1-2/h4H,1-3H3;1H2.
What are the key properties of formaldehyde;2-methylpropane?
formaldehyde;2-methylpropane has a molecular weight of 88.15 g/mol, XLogP of 1.48, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;2-methylpropane is sourced from PubChem (CID 157396277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).