AB48581
6942-37-6 | Methyl 5-amino-2-bromobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB48581
ChemicalName
Methyl 5-amino-2-bromobenzoate
CasNumber
6942-37-6
MolecularFormula
C8H8BrNO2
MolecularWeight
230.0586
MdlNumber
MFCD00085568
Smiles
COC(=O)c1cc(N)ccc1Br
NscNumber
57463
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.8
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CatalogNumber: AB48581
ChemicalName: Methyl 5-amino-2-bromobenzoate
CasNumber: 6942-37-6
MolecularFormula: C8H8BrNO2
MolecularWeight: 230.0586
MdlNumber: MFCD00085568
Smiles: COC(=O)c1cc(N)ccc1Br
NscNumber: 57463
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AB48581
ChemicalName:
Methyl 5-amino-2-bromobenzoate
CasNumber:
6942-37-6
MolecularFormula:
C8H8BrNO2
MolecularWeight:
230.0586
MdlNumber:
MFCD00085568
Smiles:
COC(=O)c1cc(N)ccc1Br
NscNumber:
57463
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)O[C@@H]1O[C@@H]([C@H]([C@H]1OCc1ccccc1)OCc1ccccc1)COCc1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)O[C@@H]1O[C@@H]([C@H]([C@H]1OCc1ccccc1)OCc1ccccc1)COCc1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB48583
ChemicalName: Ethyl 4-oxopyrrolidine-3-carboxylate hydrochloride
CasNumber: 916814-29-4
MolecularFormula: C7H12ClNO3
MolecularWeight: 193.6281
MdlNumber: MFCD17012780
Smiles: CCOC(=O)C1CNCC1=O.Cl
NscNumber: __
Complexity: 179
Covalently-bondedUnitCount: 2
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB48583
ChemicalName:
Ethyl 4-oxopyrrolidine-3-carboxylate hydrochloride
CasNumber:
916814-29-4
MolecularFormula:
C7H12ClNO3
MolecularWeight:
193.6281
MdlNumber:
MFCD17012780
Smiles:
CCOC(=O)C1CNCC1=O.Cl
NscNumber:
__
Complexity:
179
Covalently-bondedUnitCount:
2
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: AB48584
ChemicalName: 3-(Methoxymethyl)pyrrolidine
CasNumber: 936940-38-4
MolecularFormula: C6H13NO
MolecularWeight: 115.1735
MdlNumber: MFCD08688059
Smiles: COCC1CNCC1
NscNumber: __
Complexity: 65.5
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AB48584
ChemicalName:
3-(Methoxymethyl)pyrrolidine
CasNumber:
936940-38-4
MolecularFormula:
C6H13NO
MolecularWeight:
115.1735
MdlNumber:
MFCD08688059
Smiles:
COCC1CNCC1
NscNumber:
__
Complexity:
65.5
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
__