AA18910
1145786-74-8 | (1S)-1-(4-Fluorophenyl)propylamine hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AA18910
ChemicalName
(1S)-1-(4-Fluorophenyl)propylamine hydrochloride
CasNumber
1145786-74-8
MolecularFormula
C9H13ClFN
MolecularWeight
189.6576
MdlNumber
MFCD11101159
Smiles
CC[C@@H](c1ccc(cc1)F)N.Cl
Complexity
108
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AA18910
ChemicalName: (1S)-1-(4-Fluorophenyl)propylamine hydrochloride
CasNumber: 1145786-74-8
MolecularFormula: C9H13ClFN
MolecularWeight: 189.6576
MdlNumber: MFCD11101159
Smiles: CC[C@@H](c1ccc(cc1)F)N.Cl
Complexity: 108
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AA18910
ChemicalName:
(1S)-1-(4-Fluorophenyl)propylamine hydrochloride
CasNumber:
1145786-74-8
MolecularFormula:
C9H13ClFN
MolecularWeight:
189.6576
MdlNumber:
MFCD11101159
Smiles:
CC[C@@H](c1ccc(cc1)F)N.Cl
Complexity:
108
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
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Smiles: COc1cc(ccc1n1cnc(c1)C)B(O)O
Complexity: __
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Smiles:
COc1cc(ccc1n1cnc(c1)C)B(O)O
Complexity:
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Smiles: CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]2[C@@H]3CC[C@]3([C@]2(O)CC[C@@H]3C2=CC(=O)OC2)C)C)O[C@H]([C@@H]1O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)C
Complexity: __
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Smiles:
CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]2[C@@H]3CC[C@]3([C@]2(O)CC[C@@H]3C2=CC(=O)OC2)C)C)O[C@H]([C@@H]1O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)C
Complexity:
__
Covalently-bondedUnitCount:
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Brc1c2cc(ccc2c(c2c1cccc2)Br)C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1c2cc(ccc2c(c2c1cccc2)Br)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__