CID 10916947

C8H11 — CID 10916947

IUPAC—
SMILESCC(C)C1=CC=C[CH]1
InChIInChI=1S/C8H11/c1-7(2)8-5-3-4-6-8/h3-7H,1-2H3
InChIKeyMCDFAVQRBQQKCB-UHFFFAOYSA-N
MW107.18 g/mol
LogP2.34
Rot. Bonds1

About CID 10916947

CID 10916947 (PubChem CID 10916947) has the molecular formula C8H11 and a molecular weight of 107.18 g/mol.

Molecular Properties

Compound NameCID 10916947
PubChem CID10916947
Molecular FormulaC8H11
Molecular Weight107.18 g/mol
Exact Mass107.09
IUPAC Name—
SMILESCC(C)C1=CC=C[CH]1
InChIInChI=1S/C8H11/c1-7(2)8-5-3-4-6-8/h3-7H,1-2H3
InChIKeyMCDFAVQRBQQKCB-UHFFFAOYSA-N
XLogP2.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.18
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 10916947?
The IUPAC name of CID 10916947 (CID 10916947) is not available.
What is the SMILES notation for CID 10916947?
The canonical SMILES for CID 10916947 is CC(C)C1=CC=C[CH]1.
What is the InChIKey of CID 10916947?
The InChIKey is MCDFAVQRBQQKCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11/c1-7(2)8-5-3-4-6-8/h3-7H,1-2H3.
What are the key properties of CID 10916947?
CID 10916947 has a molecular weight of 107.18 g/mol, XLogP of 2.34, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10916947 is sourced from PubChem (CID 10916947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).