C1=CC=C(C=C1)COC(=O)C#N
CAS: 5532-86-5
الاسم: benzyl cyanoformate
SMILES: C1=CC=C(C=C1)COC(=O)C#N

Molecular Processing

Molecular formula
C9H7NO2
Molecular weight
161.16
Exact mass
161.0477
XLogP
1.25
TPSA
50.09
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
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
0.111
Molar refractivity
41.85

Supplementary Information

InChIKey: GDZIODIYBLTRRJ-UHFFFAOYSA-N
مرادفات
Benzyl cyanoformateCarbonocyanidic acid, phenylmethyl esterBJ8E5TW8ASEINECS 226-880-8DTXSID10203883PHENYLMETHYL CARBONOCYANIDATERefChem:118864DTXCID40126374226-880-8GDZIODIYBLTRRJ-UHFFFAOYSA-N5532-86-5benzyl carbonocyanidatephenylmethyl cyanoformatebenzylcyanoformatbenzylcarbonocyanidateUNII-BJ8E5TW8ASBenzyl cyanoformate, 97%SCHEMBL1400119FAA53286MFCD00001835SBB057332AKOS015889535([(Cyanocarbonyl)oxy]methyl)benzene #SY204966CS-0242651NS00033291ST50997662EN300-253334H85917
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