AB79404
95656-86-3 | tert-Butyl N-(2-hydroxypropyl)carbamate
Manufacturer: A2B Chem
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CatalogNumber
AB79404
ChemicalName
tert-Butyl N-(2-hydroxypropyl)carbamate
CasNumber
95656-86-3
MolecularFormula
C8H17NO3
MolecularWeight
175.2255
MdlNumber
MFCD02093569
Smiles
CC(CNC(=O)OC(C)(C)C)O
Complexity
151
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
0.7
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CatalogNumber: AB79404
ChemicalName: tert-Butyl N-(2-hydroxypropyl)carbamate
CasNumber: 95656-86-3
MolecularFormula: C8H17NO3
MolecularWeight: 175.2255
MdlNumber: MFCD02093569
Smiles: CC(CNC(=O)OC(C)(C)C)O
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.7
CatalogNumber:
AB79404
ChemicalName:
tert-Butyl N-(2-hydroxypropyl)carbamate
CasNumber:
95656-86-3
MolecularFormula:
C8H17NO3
MolecularWeight:
175.2255
MdlNumber:
MFCD02093569
Smiles:
CC(CNC(=O)OC(C)(C)C)O
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OC(C)(C)C)NOCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OC(C)(C)C)NOCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OC(C)(C)C)ONC(=O)OC(C)(C)C
Complexity: 261
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OC(C)(C)C)ONC(=O)OC(C)(C)C
Complexity:
261
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.4
CatalogNumber: AB79408
ChemicalName: 2-(N-Boc-amino)pyridine-3-boronic acid, pinacol ester
CasNumber: 1072944-99-0
MolecularFormula: C16H25BN2O4
MolecularWeight: 320.1917
MdlNumber: MFCD08063072
Smiles: O=C(OC(C)(C)C)Nc1ncccc1B1OC(C(O1)(C)C)(C)C
Complexity: 432
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB79408
ChemicalName:
2-(N-Boc-amino)pyridine-3-boronic acid, pinacol ester
CasNumber:
1072944-99-0
MolecularFormula:
C16H25BN2O4
MolecularWeight:
320.1917
MdlNumber:
MFCD08063072
Smiles:
O=C(OC(C)(C)C)Nc1ncccc1B1OC(C(O1)(C)C)(C)C
Complexity:
432
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
__
Xlogp3:
__