AB77102
98642-44-5 | tert-Butyl 3-hydroxypropylmethylcarbamate
Manufacturer: A2B Chem
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CatalogNumber
AB77102
ChemicalName
tert-Butyl 3-hydroxypropylmethylcarbamate
CasNumber
98642-44-5
MolecularFormula
C9H19NO3
MolecularWeight
189.25206000000003
MdlNumber
MFCD09751790
Smiles
OCCCN(C(=O)OC(C)(C)C)C
Complexity
163
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
0.8
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CatalogNumber: AB77102
ChemicalName: tert-Butyl 3-hydroxypropylmethylcarbamate
CasNumber: 98642-44-5
MolecularFormula: C9H19NO3
MolecularWeight: 189.25206000000003
MdlNumber: MFCD09751790
Smiles: OCCCN(C(=O)OC(C)(C)C)C
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 0.8
CatalogNumber:
AB77102
ChemicalName:
tert-Butyl 3-hydroxypropylmethylcarbamate
CasNumber:
98642-44-5
MolecularFormula:
C9H19NO3
MolecularWeight:
189.25206000000003
MdlNumber:
MFCD09751790
Smiles:
OCCCN(C(=O)OC(C)(C)C)C
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
0.8
CatalogNumber: AB77103
ChemicalName: N-Boc-3-bromo-4-fluoroaniline
CasNumber: 836619-77-3
MolecularFormula: C11H13BrFNO2
MolecularWeight: 290.1288
MdlNumber: MFCD11975628
Smiles: O=C(OC(C)(C)C)Nc1ccc(c(c1)Br)F
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.3
CatalogNumber:
AB77103
ChemicalName:
N-Boc-3-bromo-4-fluoroaniline
CasNumber:
836619-77-3
MolecularFormula:
C11H13BrFNO2
MolecularWeight:
290.1288
MdlNumber:
MFCD11975628
Smiles:
O=C(OC(C)(C)C)Nc1ccc(c(c1)Br)F
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.3
CatalogNumber: AB77104
ChemicalName: 1-Boc-3-bromomethylpiperidine
CasNumber: 193629-39-9
MolecularFormula: C11H20BrNO2
MolecularWeight: 278.186
MdlNumber: MFCD04115539
Smiles: BrCC1CCCN(C1)C(=O)OC(C)(C)C
Complexity: 225
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 2.6
CatalogNumber:
AB77104
ChemicalName:
1-Boc-3-bromomethylpiperidine
CasNumber:
193629-39-9
MolecularFormula:
C11H20BrNO2
MolecularWeight:
278.186
MdlNumber:
MFCD04115539
Smiles:
BrCC1CCCN(C1)C(=O)OC(C)(C)C
Complexity:
225
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
2.6
CatalogNumber: AB77105
ChemicalName: N-Boc-3-carboethoxy-4-piperidone
CasNumber: 98977-34-5
MolecularFormula: C13H21NO5
MolecularWeight: 271.3095
MdlNumber: MFCD01862189
Smiles: CCOC(=O)C1CN(CCC1=O)C(=O)OC(C)(C)C
Complexity: 372
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 5
Xlogp3: 1.1
CatalogNumber:
AB77105
ChemicalName:
N-Boc-3-carboethoxy-4-piperidone
CasNumber:
98977-34-5
MolecularFormula:
C13H21NO5
MolecularWeight:
271.3095
MdlNumber:
MFCD01862189
Smiles:
CCOC(=O)C1CN(CCC1=O)C(=O)OC(C)(C)C
Complexity:
372
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
5
Xlogp3:
1.1