AB49298
34582-33-7 | H-Glu(ome)-otbu hcl
Manufacturer: A2B Chem
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CatalogNumber
AB49298
ChemicalName
H-Glu(ome)-otbu hcl
CasNumber
34582-33-7
MolecularFormula
C10H20ClNO4
MolecularWeight
253.7231
MdlNumber
MFCD00039358
Smiles
COC(=O)CC[C@@H](C(=O)OC(C)(C)C)N.Cl
Complexity
232
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
7
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CatalogNumber: AB49298
ChemicalName: H-Glu(ome)-otbu hcl
CasNumber: 34582-33-7
MolecularFormula: C10H20ClNO4
MolecularWeight: 253.7231
MdlNumber: MFCD00039358
Smiles: COC(=O)CC[C@@H](C(=O)OC(C)(C)C)N.Cl
Complexity: 232
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 7
CatalogNumber:
AB49298
ChemicalName:
H-Glu(ome)-otbu hcl
CasNumber:
34582-33-7
MolecularFormula:
C10H20ClNO4
MolecularWeight:
253.7231
MdlNumber:
MFCD00039358
Smiles:
COC(=O)CC[C@@H](C(=O)OC(C)(C)C)N.Cl
Complexity:
232
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C/C(=C\C(=O)O)/CCC
Complexity: 125
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C/C(=C\C(=O)O)/CCC
Complexity:
125
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1CC2CCN1CC2.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1CC2CCN1CC2.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AB49301
ChemicalName: Methyl 3-bromo-5-fluorobenzoate
CasNumber: 334792-52-8
MolecularFormula: C8H6BrFO2
MolecularWeight: 233.0344
MdlNumber: MFCD07780735
Smiles: COC(=O)c1cc(F)cc(c1)Br
Complexity: 174
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
CatalogNumber:
AB49301
ChemicalName:
Methyl 3-bromo-5-fluorobenzoate
CasNumber:
334792-52-8
MolecularFormula:
C8H6BrFO2
MolecularWeight:
233.0344
MdlNumber:
MFCD07780735
Smiles:
COC(=O)c1cc(F)cc(c1)Br
Complexity:
174
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2