CCCCOC(=O)Cl
CAS: 592-34-7
Name: butyl carbonochloridate
SMILES: CCCCOC(=O)Cl

Molecular Processing

Molecular formula
C5H9ClO2
Molecular weight
136.58
Exact mass
136.0291
XLogP
2.16
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
32.11

Supplementary Information

InChIKey: NRDQFWXVTPZZAZ-UHFFFAOYSA-N
Synonyme
Butyl chloroformate592-34-7n-Butyl chloroformatebutyl carbonochloridateCARBONOCHLORIDIC ACID, BUTYL ESTERNSC 84283TGX130CB0Chloroformic acid n-butyl estern-butyl chlorocarbonateNSC-8428EINECS 209-750-5UN2743UNII-3TGX130CB0AI3-28574BUTAN-1-YL CHLOROFORMATEDTXSID7060461NRDQFWXVTPZZAZ-UHFFFAOYSA-EC 209-750-5UN 2743BUTYL CHLOROFORMATE; FORMIC ACID, CHLORO-, BUTYL ESTERRefChem:122235DTXCID2042567Formic acid, chloro, butyl esterCHLOROFORMIC ACID, N-BUTYL ESTERCHLOROCARBONIC ACID, N-BUTYL ESTERFormic acid, chloro, butyl ester (8CI)InChI=1/C5H9ClO2/c1-2-3-4-8-5(6)7/h2-4H2,1H3NRDQFWXVTPZZAZ-UHFFFAOYSA-NButyl chlorocarbonateChloroformic acid butyl ester
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