AA31598
1257213-52-7 | 4-(1-Ethoxycarbonylcyclopropyl)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA31598
ChemicalName
4-(1-Ethoxycarbonylcyclopropyl)phenylboronic acid, pinacol ester
CasNumber
1257213-52-7
MolecularFormula
C18H25BO4
MolecularWeight
316.1997
MdlNumber
MFCD18383419
Smiles
CCOC(=O)C1(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity
446
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
4
RotatableBondCount
5
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CatalogNumber: AA31598
ChemicalName: 4-(1-Ethoxycarbonylcyclopropyl)phenylboronic acid, pinacol ester
CasNumber: 1257213-52-7
MolecularFormula: C18H25BO4
MolecularWeight: 316.1997
MdlNumber: MFCD18383419
Smiles: CCOC(=O)C1(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 446
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
CatalogNumber:
AA31598
ChemicalName:
4-(1-Ethoxycarbonylcyclopropyl)phenylboronic acid, pinacol ester
CasNumber:
1257213-52-7
MolecularFormula:
C18H25BO4
MolecularWeight:
316.1997
MdlNumber:
MFCD18383419
Smiles:
CCOC(=O)C1(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
446
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(O[C@@H](c1ccccc1)C)Nc1c(C)noc1c1ccc(cc1)c1ccc(cc1)C1(CC1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(O[C@@H](c1ccccc1)C)Nc1c(C)noc1c1ccc(cc1)c1ccc(cc1)C1(CC1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(c1ccncn1)N.Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC(c1ccncn1)N.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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CatalogNumber: AA31601
ChemicalName: (R)-1-(3-Chloro-4-fluorophenyl)ethanamine hydrochloride
CasNumber: 1257106-65-2
MolecularFormula: C8H10Cl2FN
MolecularWeight: 210.0761
MdlNumber: MFCD12758039
Smiles: C[C@H](c1ccc(c(c1)Cl)F)N.Cl
Complexity: 131
Covalently-bondedUnitCount: 2
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
CatalogNumber:
AA31601
ChemicalName:
(R)-1-(3-Chloro-4-fluorophenyl)ethanamine hydrochloride
CasNumber:
1257106-65-2
MolecularFormula:
C8H10Cl2FN
MolecularWeight:
210.0761
MdlNumber:
MFCD12758039
Smiles:
C[C@H](c1ccc(c(c1)Cl)F)N.Cl
Complexity:
131
Covalently-bondedUnitCount:
2
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1