1-(chloromethyl)-2-methylidenecyclopropane

C5H7Cl — CID 55303574

IUPAC1-(chloromethyl)-2-methylidenecyclopropane
SMILESC=C1CC1CCl
InChIInChI=1S/C5H7Cl/c1-4-2-5(4)3-6/h5H,1-3H2
InChIKeyNHZFFAWWSQLSQD-UHFFFAOYSA-N
MW102.56 g/mol
LogP1.80
Rot. Bonds1

About 1-(chloromethyl)-2-methylidenecyclopropane

1-(chloromethyl)-2-methylidenecyclopropane (PubChem CID 55303574) has the molecular formula C5H7Cl and a molecular weight of 102.56 g/mol. Its IUPAC name is 1-(chloromethyl)-2-methylidenecyclopropane.

Molecular Properties

Compound Name1-(chloromethyl)-2-methylidenecyclopropane
PubChem CID55303574
Molecular FormulaC5H7Cl
Molecular Weight102.56 g/mol
Exact Mass102.02
IUPAC Name1-(chloromethyl)-2-methylidenecyclopropane
SMILESC=C1CC1CCl
InChIInChI=1S/C5H7Cl/c1-4-2-5(4)3-6/h5H,1-3H2
InChIKeyNHZFFAWWSQLSQD-UHFFFAOYSA-N
XLogP1.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.56
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-heptyl-2-methylidenecyclopropane
CID 173435427
N-methyl-2-(2-methylidenecyclopropyl)ethanamine
CID 147248580
1-methylidene-2-(3,3,3-trifluoropropyl)cyclopropane
CID 155429893
2,3,6,7-tetrakis(chloromethyl)-1,2,3,4,5,6,7,8-octahydronaphthalene
CID 117070544
2-amino-3-[(1R)-2-methylidenecyclopropyl]propanoic acid
CID 175266856
(2R)-2-amino-3-(2-methylidenecyclopropyl)propanoic acid
CID 131034115
1-[(4-chloro-2-methylidenecyclohexyl)methyl]-4-methylpiperazine
CID 123793147
1-[di(propan-2-yloxy)phosphorylmethyl]-2-methylidenecyclopropane
CID 101187650
1,2,3,4-tetrachloro-5-methylidenecyclohexane
CID 90888986
2-(2-chloroethyl)-1,1-dimethyl-3-methylidenecyclohexane
CID 71402169
1-hexyl-4-methyl-2-methylidenecyclopentane
CID 143150354
4-(chloromethyl)-1,2-thiazolidin-3-one
CID 70150343

Frequently Asked Questions

What is the IUPAC name of 1-(chloromethyl)-2-methylidenecyclopropane?
The IUPAC name of 1-(chloromethyl)-2-methylidenecyclopropane (CID 55303574) is 1-(chloromethyl)-2-methylidenecyclopropane.
What is the SMILES notation for 1-(chloromethyl)-2-methylidenecyclopropane?
The canonical SMILES for 1-(chloromethyl)-2-methylidenecyclopropane is C=C1CC1CCl.
What is the InChIKey of 1-(chloromethyl)-2-methylidenecyclopropane?
The InChIKey is NHZFFAWWSQLSQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7Cl/c1-4-2-5(4)3-6/h5H,1-3H2.
What are the key properties of 1-(chloromethyl)-2-methylidenecyclopropane?
1-(chloromethyl)-2-methylidenecyclopropane has a molecular weight of 102.56 g/mol, XLogP of 1.80, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(chloromethyl)-2-methylidenecyclopropane is sourced from PubChem (CID 55303574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).