C1=CC(=CC=C1COC(=O)Cl)[N+](=O)[O-]
CAS: 4457-32-3
Name: (4-nitrophenyl)methyl carbonochloridate
SMILES: C1=CC(=CC=C1COC(=O)Cl)[N+](=O)[O-]

Molecular Processing

Molecular formula
C8H6ClNO4
Molecular weight
215.59
Exact mass
214.9985
XLogP
2.47
TPSA
69.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
49.13

Supplementary Information

InChIKey: MHSGOABISYIYKP-UHFFFAOYSA-N
Synonyme
4-Nitrobenzyl chloroformate4457-32-3Carbonochloridic acid, (4-nitrophenyl)methyl ester(4-nitrophenyl)methyl carbonochloridatep-Nitrobenzyl chloroformate4-Nitrobenzyloxycarbonyl chlorideDG2GS0JJV0EINECS 224-708-6DTXSID6063482RefChem:525942DTXCID4040341224-708-64-Nitrobenzyl carbonochloridate4-NitrocarbobenzoxychlorideChloroformic Acid 4-Nitrobenzyl Ester(4-nitrophenyl)methyl chloroformateChloroformic acid p-nitrobenzyl esterMFCD00007375p-Nitrobenzyloxycarbonyl chloride4-Nitrobenzyl ChlorocarbonateFormic acid, chloro-, p-nitrobenzyl esterChloroformic Acid p-Nitrobenzyl Ester; 4-Nitrobenzyl Chloroformate; 4-Nitrobenzyloxycarbonyl Chloride; p-Nitrobenzyl Chloroformate; p-Nitrobenzyloxycarbonyl Chloride; p-Nitrocarbobenzoxy Chloride4nitrobenzyl chloroformateUNII-DG2GS0JJV0p-Nitrocarbobenzoxy chloridep-nitrobenzyl chlorocarbonate(4-nitrobenzyl)chloroformate4-Nitrobenzylcarbonochloridate4-(nitro)benzyl chloroformateSCHEMBL158920
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