C1CCC(CC1)(C(=O)O)NC(=O)OCC2=CC=CO2
CAS: 944280-84-6
الاسم: 1-(furan-2-ylmethoxycarbonylamino)cyclohexane-1-carboxylic acid
SMILES: C1CCC(CC1)(C(=O)O)NC(=O)OCC2=CC=CO2

Molecular Processing

Molecular formula
C13H17NO5
Molecular weight
267.28
Exact mass
267.1107
XLogP
2.29
TPSA
88.77
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
65.48

Supplementary Information

InChIKey: JLWNCBVCCGLTKU-UHFFFAOYSA-N
مرادفات
SCHEMBL1838094JLWNCBVCCGLTKU-UHFFFAOYSA-NDB-1312951-[[(2-Furanylmethoxy)carbonyl]amino]cyclohexanecarboxylic acid1-(((Furan-2-ylmethoxy)carbonyl)amino)cyclohexane-1-carboxylic acid944280-84-6
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