(E)-1-chloroprop-1-ene

C3H5Cl — CID 5284364

IUPAC(E)-1-chloroprop-1-ene
SMILESC/C=C/Cl
InChIInChI=1S/C3H5Cl/c1-2-3-4/h2-3H,1H3/b3-2+
InChIKeyOWXJKYNZGFSVRC-NSCUHMNNSA-N
MW76.53 g/mol
LogP1.76
Rot. Bonds

About (E)-1-chloroprop-1-ene

(E)-1-chloroprop-1-ene (PubChem CID 5284364) has the molecular formula C3H5Cl and a molecular weight of 76.53 g/mol. Its IUPAC name is (E)-1-chloroprop-1-ene.

Molecular Properties

Compound Name(E)-1-chloroprop-1-ene
PubChem CID5284364
Molecular FormulaC3H5Cl
Molecular Weight76.53 g/mol
Exact Mass76.01
IUPAC Name(E)-1-chloroprop-1-ene
SMILESC/C=C/Cl
InChIInChI=1S/C3H5Cl/c1-2-3-4/h2-3H,1H3/b3-2+
InChIKeyOWXJKYNZGFSVRC-NSCUHMNNSA-N
XLogP1.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50076.53
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Allyl chloride
CID 7850
1,3-Dichloropropene
CID 24883
(Z)-1,3-Dichloropropene
CID 5280970
(E)-1,3-Dichloropropene
CID 24726
1-Chloro-1-propene
CID 11536
3,3-Dichloropropene
CID 11244
3-Chloro-1-butene
CID 11242
Crotyl chloride
CID 11589
(2E)-1-Chloro-2-butene
CID 637923
1-Propene, 1-chloro-, (1Z)-
CID 5326315
1-Chloro-1-butene
CID 5463507
1-Chlorobuta-1,3-diene
CID 5462923

Frequently Asked Questions

What is the IUPAC name of (E)-1-chloroprop-1-ene?
The IUPAC name of (E)-1-chloroprop-1-ene (CID 5284364) is (E)-1-chloroprop-1-ene.
What is the SMILES notation for (E)-1-chloroprop-1-ene?
The canonical SMILES for (E)-1-chloroprop-1-ene is C/C=C/Cl.
What is the InChIKey of (E)-1-chloroprop-1-ene?
The InChIKey is OWXJKYNZGFSVRC-NSCUHMNNSA-N. The full InChI is InChI=1S/C3H5Cl/c1-2-3-4/h2-3H,1H3/b3-2+.
What are the key properties of (E)-1-chloroprop-1-ene?
(E)-1-chloroprop-1-ene has a molecular weight of 76.53 g/mol, XLogP of 1.76, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-chloroprop-1-ene is sourced from PubChem (CID 5284364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).