AA14611
116026-99-4 | (2-Formyl-pyridin-3-yl)-carbamic acid tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AA14611
ChemicalName
(2-Formyl-pyridin-3-yl)-carbamic acid tert-butyl ester
CasNumber
116026-99-4
MolecularFormula
C11H14N2O3
MolecularWeight
222.2405
MdlNumber
MFCD04035594
Smiles
O=Cc1ncccc1NC(=O)OC(C)(C)C
Complexity
260
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
1.8
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CatalogNumber: AA14611
ChemicalName: (2-Formyl-pyridin-3-yl)-carbamic acid tert-butyl ester
CasNumber: 116026-99-4
MolecularFormula: C11H14N2O3
MolecularWeight: 222.2405
MdlNumber: MFCD04035594
Smiles: O=Cc1ncccc1NC(=O)OC(C)(C)C
Complexity: 260
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 1.8
CatalogNumber:
AA14611
ChemicalName:
(2-Formyl-pyridin-3-yl)-carbamic acid tert-butyl ester
CasNumber:
116026-99-4
MolecularFormula:
C11H14N2O3
MolecularWeight:
222.2405
MdlNumber:
MFCD04035594
Smiles:
O=Cc1ncccc1NC(=O)OC(C)(C)C
Complexity:
260
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
1.8
CatalogNumber: AA14612
ChemicalName: tert-Butyl 2-bromopyridin-3-ylcarbamate
CasNumber: 116026-98-3
MolecularFormula: C10H13BrN2O2
MolecularWeight: 273.1264
MdlNumber: MFCD07367911
Smiles: O=C(Nc1cccnc1Br)OC(C)(C)C
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AA14612
ChemicalName:
tert-Butyl 2-bromopyridin-3-ylcarbamate
CasNumber:
116026-98-3
MolecularFormula:
C10H13BrN2O2
MolecularWeight:
273.1264
MdlNumber:
MFCD07367911
Smiles:
O=C(Nc1cccnc1Br)OC(C)(C)C
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.4
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O=Cc1ccncc1NC(=O)OC(C)(C)C
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Smiles: O=Cc1cccnc1NC(=O)OC(C)(C)C
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Smiles:
O=Cc1cccnc1NC(=O)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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