AA97395
1820574-01-3 | (R)-1-(3-Chloro-5-fluorophenyl)ethanamine hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AA97395
ChemicalName
(R)-1-(3-Chloro-5-fluorophenyl)ethanamine hydrochloride
CasNumber
1820574-01-3
MolecularFormula
C8H10Cl2FN
MolecularWeight
210.0761
MdlNumber
MFCD12758063
Smiles
Fc1cc(Cl)cc(c1)[C@H](N)C.Cl
Complexity
131
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
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CatalogNumber: AA97395
ChemicalName: (R)-1-(3-Chloro-5-fluorophenyl)ethanamine hydrochloride
CasNumber: 1820574-01-3
MolecularFormula: C8H10Cl2FN
MolecularWeight: 210.0761
MdlNumber: MFCD12758063
Smiles: Fc1cc(Cl)cc(c1)[C@H](N)C.Cl
Complexity: 131
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AA97395
ChemicalName:
(R)-1-(3-Chloro-5-fluorophenyl)ethanamine hydrochloride
CasNumber:
1820574-01-3
MolecularFormula:
C8H10Cl2FN
MolecularWeight:
210.0761
MdlNumber:
MFCD12758063
Smiles:
Fc1cc(Cl)cc(c1)[C@H](N)C.Cl
Complexity:
131
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
CatalogNumber: AA97398
ChemicalName: (2R,4S)-1-Fmoc-4-Boc-amino pyrrolidine-2-carboxylic acid
CasNumber: 1820570-42-0
MolecularFormula: C25H28N2O6
MolecularWeight: 452.4996199999999
MdlNumber: MFCD12755471
Smiles: O=C(OC(C)(C)C)N[C@@H]1CN([C@H](C1)C(=O)O)C(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: 728
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 33
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 7
CatalogNumber:
AA97398
ChemicalName:
(2R,4S)-1-Fmoc-4-Boc-amino pyrrolidine-2-carboxylic acid
CasNumber:
1820570-42-0
MolecularFormula:
C25H28N2O6
MolecularWeight:
452.4996199999999
MdlNumber:
MFCD12755471
Smiles:
O=C(OC(C)(C)C)N[C@@H]1CN([C@H](C1)C(=O)O)C(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
728
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
33
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
7
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Smiles: OC(=O)C(F)(F)F.O=C(N[C@H](C(=O)NCC(=O)O)C(C)C)CC[C@@H](C(=O)O)N
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Smiles:
OC(=O)C(F)(F)F.O=C(N[C@H](C(=O)NCC(=O)O)C(C)C)CC[C@@H](C(=O)O)N
Complexity:
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Smiles: O=C(N[C@@H](C(=O)O)Cc1nnn(n1)C(c1ccccc1)(c1ccccc1)c1ccccc1)OCC1c2ccccc2-c2c1cccc2
Complexity: __
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HeavyAtomCount: __
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RotatableBondCount: __
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Smiles:
O=C(N[C@@H](C(=O)O)Cc1nnn(n1)C(c1ccccc1)(c1ccccc1)c1ccccc1)OCC1c2ccccc2-c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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