AF36944
22233-82-5 | (E)-1-(2,6-Dihydroxyphenyl)ethanone oxime
Manufacturer: A2B Chem
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CatalogNumber
AF36944
ChemicalName
(E)-1-(2,6-Dihydroxyphenyl)ethanone oxime
CasNumber
22233-82-5
MolecularFormula
C8H9NO3
MolecularWeight
167.162
MdlNumber
MFCD26383418
Smiles
O/N=C(/c1c(O)cccc1O)C
Complexity
171
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
1
UndefinedBondStereocenterCount
1
Xlogp3
1.2
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CatalogNumber: AF36944
ChemicalName: (E)-1-(2,6-Dihydroxyphenyl)ethanone oxime
CasNumber: 22233-82-5
MolecularFormula: C8H9NO3
MolecularWeight: 167.162
MdlNumber: MFCD26383418
Smiles: O/N=C(/c1c(O)cccc1O)C
Complexity: 171
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 1
UndefinedBondStereocenterCount: 1
Xlogp3: 1.2
CatalogNumber:
AF36944
ChemicalName:
(E)-1-(2,6-Dihydroxyphenyl)ethanone oxime
CasNumber:
22233-82-5
MolecularFormula:
C8H9NO3
MolecularWeight:
167.162
MdlNumber:
MFCD26383418
Smiles:
O/N=C(/c1c(O)cccc1O)C
Complexity:
171
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
1
UndefinedBondStereocenterCount:
1
Xlogp3:
1.2
CatalogNumber: AF36945
ChemicalName: 2-(Dimethylamino)-2-methylpropanenitrile
CasNumber: 2273-40-7
MolecularFormula: C6H12N2
MolecularWeight: 112.1729
MdlNumber: MFCD10005348
Smiles: CN(C(C#N)(C)C)C
Complexity: 116
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
UndefinedBondStereocenterCount: __
Xlogp3: 0.6
CatalogNumber:
AF36945
ChemicalName:
2-(Dimethylamino)-2-methylpropanenitrile
CasNumber:
2273-40-7
MolecularFormula:
C6H12N2
MolecularWeight:
112.1729
MdlNumber:
MFCD10005348
Smiles:
CN(C(C#N)(C)C)C
Complexity:
116
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
UndefinedBondStereocenterCount:
__
Xlogp3:
0.6
CatalogNumber: AF36946
ChemicalName: Methyl 1-tosyl-1h-pyrrole-3-carboxylate
CasNumber: 212071-00-6
MolecularFormula: C13H13NO4S
MolecularWeight: 279.3116
MdlNumber: MFCD09743411
Smiles: COC(=O)c1ccn(c1)S(=O)(=O)c1ccc(cc1)C
Complexity: 420
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 4
UndefinedBondStereocenterCount: __
Xlogp3: 2.1
CatalogNumber:
AF36946
ChemicalName:
Methyl 1-tosyl-1h-pyrrole-3-carboxylate
CasNumber:
212071-00-6
MolecularFormula:
C13H13NO4S
MolecularWeight:
279.3116
MdlNumber:
MFCD09743411
Smiles:
COC(=O)c1ccn(c1)S(=O)(=O)c1ccc(cc1)C
Complexity:
420
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
4
UndefinedBondStereocenterCount:
__
Xlogp3:
2.1
CatalogNumber: AF36947
ChemicalName: 4-Nitro-2-(trifluoromethyl)phenylacetic acid
CasNumber: 199469-91-5
MolecularFormula: C9H6F3NO4
MolecularWeight: 249.14344959999997
MdlNumber: MFCD11036389
Smiles: OC(=O)Cc1ccc(cc1C(F)(F)F)N(=O)=O
Complexity: 312
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedBondStereocenterCount: __
Xlogp3: 2.1
CatalogNumber:
AF36947
ChemicalName:
4-Nitro-2-(trifluoromethyl)phenylacetic acid
CasNumber:
199469-91-5
MolecularFormula:
C9H6F3NO4
MolecularWeight:
249.14344959999997
MdlNumber:
MFCD11036389
Smiles:
OC(=O)Cc1ccc(cc1C(F)(F)F)N(=O)=O
Complexity:
312
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedBondStereocenterCount:
__
Xlogp3:
2.1