Cc1nc(C(=O)O)c(C)o1
CAS: 23000-14-8
Name: 2,5-dimethyl-1,3-oxazole-4-carboxylic acid
SMILES: Cc1nc(C(=O)O)c(C)o1

Molecular Processing

Molecular formula
C6H7NO3
Molecular weight
141.13
Exact mass
141.0426
XLogP
0.99
TPSA
63.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
32.94

Supplementary Information

InChIKey: LHGRUGVXZLHYKE-UHFFFAOYSA-N
Synonyme
23000-14-82,5-dimethyl-1,3-oxazole-4-carboxylic acidDTXSID40383687RefChem:444481DTXCID00334711822-871-32,5-Dimethyloxazole-4-carboxylic aciddimethyl-1,3-oxazole-4-carboxylic acid4-Oxazolecarboxylic acid, 2,5-dimethyl-MFCD030115952,5-Dimethyl-1,3-Oxazole-4-CarboxylicAcidSCHEMBL287238oxazole, 4-carboxy-2,5-dimethyl-SBB049079STK5048592,5-Dimethyloxazole-4-carboxylicacidAKOS002307125PS-37242,5-dimethyl-oxazole-4-carboxylic acidSY139246DB-009168CS-0082121ST507669552.5-dimethyl-1,3-oxazole-4-carboxylic acidEN300-104978F066205Z969117654
Quelle anzeigen →
An 43 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→