CAS: 29681-44-5
이름: methyl 5-bromopyridine-3-carboxylate
SMILES:
COC(=O)C1=CC(=CN=C1)BrMolecular Processing
Molecular formula
C7H6BrNO2
Molecular weight
216.03
Exact mass
214.9582
XLogP
1.63
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
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
0.143
Molar refractivity
43.28
Supplementary Information
InChIKey: AAJZXPWBILCHAW-UHFFFAOYSA-N
동의어
Methyl 5-bromopyridine-3-carboxylateRefChem:816988627-974-5Methyl 5-bromonicotinate29681-44-55-Bromonicotinic acid methyl ester3-PYRIDINECARBOXYLIC ACID, 5-BROMO-, METHYL ESTER5-bromo nicotinic acid methyl ester5-Bromo-3-pyridinecarboxylic Acid Methyl EsterMFCD001736685-Bromopyridine-3-carboxylic acid methyl ester3-Bromo-5-methoxycarbonylpyridineMethyl 5-Bromo-3-pyridinecarboxylatemethyl-5-bromonicotinateMaybridge3_004992methyl 5-bromo-nicotinate3-bromo-5-pyridinecarboxylic acid methyl ester5-bromo-3-pyridine carboxylic acid methyl esterLCU8QJK978SCHEMBL309752orb3027285SCHEMBL29564949DTXSID70351394AAJZXPWBILCHAW-UHFFFAOYSA-NHMS1445C205-bromo-nicotinic acid methyl esterALBB-019944STR08069methyl-5-bromopyridine-3-carboxylateRB1030
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