AB50037
185246-17-7 | 2-Chloromethyl-oxazole
Manufacturer: A2B Chem
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CatalogNumber
AB50037
ChemicalName
2-Chloromethyl-oxazole
CasNumber
185246-17-7
MolecularFormula
C4H4ClNO
MolecularWeight
117.5337
MdlNumber
MFCD04114926
Smiles
ClCc1ncco1
Complexity
59.7
Covalently-bondedUnitCount
1
HeavyAtomCount
7
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
0.8
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CatalogNumber: AB50037
ChemicalName: 2-Chloromethyl-oxazole
CasNumber: 185246-17-7
MolecularFormula: C4H4ClNO
MolecularWeight: 117.5337
MdlNumber: MFCD04114926
Smiles: ClCc1ncco1
Complexity: 59.7
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 0.8
CatalogNumber:
AB50037
ChemicalName:
2-Chloromethyl-oxazole
CasNumber:
185246-17-7
MolecularFormula:
C4H4ClNO
MolecularWeight:
117.5337
MdlNumber:
MFCD04114926
Smiles:
ClCc1ncco1
Complexity:
59.7
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1N(C)CC(=O)N2[C@@H]1Cc1c([C@H]2c2ccc3c(c2)OCO3)[nH]c2c1cccc2
Complexity: 702
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1N(C)CC(=O)N2[C@@H]1Cc1c([C@H]2c2ccc3c(c2)OCO3)[nH]c2c1cccc2
Complexity:
702
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CC2OC2CC1C1CCC2C(C1)O2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CC2OC2CC1C1CCC2C(C1)O2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB50040
ChemicalName: 2,6-Difluoronicotinic acid
CasNumber: 171178-50-0
MolecularFormula: C6H3F2NO2
MolecularWeight: 159.0903
MdlNumber: MFCD08064047
Smiles: OC(=O)c1ccc(nc1F)F
Complexity: 165
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AB50040
ChemicalName:
2,6-Difluoronicotinic acid
CasNumber:
171178-50-0
MolecularFormula:
C6H3F2NO2
MolecularWeight:
159.0903
MdlNumber:
MFCD08064047
Smiles:
OC(=O)c1ccc(nc1F)F
Complexity:
165
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
1.2