C1=COC(=N1)CCl
CAS: 185246-17-7
Name: 2-(chloromethyl)-1,3-oxazole
SMILES: C1=COC(=N1)CCl

Molecular Processing

Molecular formula
C4H4ClNO
Molecular weight
117.54
Exact mass
116.9981
XLogP
1.41
TPSA
26.03
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
7
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
26.06

Supplementary Information

InChIKey: NAOPGVBLRHCPHI-UHFFFAOYSA-N
Synonyme
185246-17-72-(chloromethyl)-1,3-oxazoleDTXSID20620784RefChem:253478DTXCID50571538800-586-52-(chloromethyl)oxazole2-Chloromethyloxazole2-Chloromethyl-oxazoleMFCD04114926chloromethyloxazoleOXAZOLE, 2-(CHLOROMETHYL)-2-chloromethyl oxazoleSCHEMBL26497SCHEMBL1975072SCHEMBL28225890NAOPGVBLRHCPHI-UHFFFAOYSA-NCS-D0011AKOS006283421AB19278AC-30982DS-12558SY016952DB-008811EN300-69577F049164
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