AB55126
110859-47-7 | (4-Benzyl-1,4-oxazinan-2-yl)methylamine
Manufacturer: A2B Chem
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CatalogNumber
AB55126
ChemicalName
(4-Benzyl-1,4-oxazinan-2-yl)methylamine
CasNumber
110859-47-7
MolecularFormula
C12H18N2O
MolecularWeight
206.2841
MdlNumber
MFCD02682010
Smiles
NCC1OCCN(C1)Cc1ccccc1
Complexity
181
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
0.5
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CatalogNumber: AB55126
ChemicalName: (4-Benzyl-1,4-oxazinan-2-yl)methylamine
CasNumber: 110859-47-7
MolecularFormula: C12H18N2O
MolecularWeight: 206.2841
MdlNumber: MFCD02682010
Smiles: NCC1OCCN(C1)Cc1ccccc1
Complexity: 181
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.5
CatalogNumber:
AB55126
ChemicalName:
(4-Benzyl-1,4-oxazinan-2-yl)methylamine
CasNumber:
110859-47-7
MolecularFormula:
C12H18N2O
MolecularWeight:
206.2841
MdlNumber:
MFCD02682010
Smiles:
NCC1OCCN(C1)Cc1ccccc1
Complexity:
181
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC1NCCN(C1)Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC1NCCN(C1)Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB55128
ChemicalName: 1-Boc-4-bromo-indole-2-boronic acid
CasNumber: 957034-29-6
MolecularFormula: C13H15BBrNO4
MolecularWeight: 339.9775
MdlNumber: MFCD06801699
Smiles: OB(c1cc2c(n1C(=O)OC(C)(C)C)cccc2Br)O
Complexity: 374
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB55128
ChemicalName:
1-Boc-4-bromo-indole-2-boronic acid
CasNumber:
957034-29-6
MolecularFormula:
C13H15BBrNO4
MolecularWeight:
339.9775
MdlNumber:
MFCD06801699
Smiles:
OB(c1cc2c(n1C(=O)OC(C)(C)C)cccc2Br)O
Complexity:
374
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB55129
ChemicalName: (4-Bromo-2-thienyl)methanol
CasNumber: 79757-77-0
MolecularFormula: C5H5BrOS
MolecularWeight: 193.0616
MdlNumber: MFCD04115392
Smiles: OCc1cc(cs1)Br
Complexity: 78.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 1.4
CatalogNumber:
AB55129
ChemicalName:
(4-Bromo-2-thienyl)methanol
CasNumber:
79757-77-0
MolecularFormula:
C5H5BrOS
MolecularWeight:
193.0616
MdlNumber:
MFCD04115392
Smiles:
OCc1cc(cs1)Br
Complexity:
78.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.4