AI43216
1894060-68-4 | 2-(2-Pyrrolidinyl)phenol hcl
Manufacturer: A2B Chem
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CatalogNumber
AI43216
ChemicalName
2-(2-Pyrrolidinyl)phenol hcl
CasNumber
1894060-68-4
MolecularFormula
C10H14ClNO
MolecularWeight
199.6773
MdlNumber
MFCD30471572
Smiles
Oc1ccccc1C1CCCN1.Cl
Complexity
149
Covalently-bondedUnitCount
2
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
3
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
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CatalogNumber: AI43216
ChemicalName: 2-(2-Pyrrolidinyl)phenol hcl
CasNumber: 1894060-68-4
MolecularFormula: C10H14ClNO
MolecularWeight: 199.6773
MdlNumber: MFCD30471572
Smiles: Oc1ccccc1C1CCCN1.Cl
Complexity: 149
Covalently-bondedUnitCount: 2
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 3
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AI43216
ChemicalName:
2-(2-Pyrrolidinyl)phenol hcl
CasNumber:
1894060-68-4
MolecularFormula:
C10H14ClNO
MolecularWeight:
199.6773
MdlNumber:
MFCD30471572
Smiles:
Oc1ccccc1C1CCCN1.Cl
Complexity:
149
Covalently-bondedUnitCount:
2
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
3
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
CatalogNumber: AI43217
ChemicalName: 3-(Pyrrolidin-2-yl)phenol hydrochloride
CasNumber: 1894060-74-2
MolecularFormula: C10H14ClNO
MolecularWeight: 199.6773
MdlNumber: MFCD30471573
Smiles: Oc1cccc(c1)C1CCCN1.Cl
Complexity: 149
Covalently-bondedUnitCount: 2
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 3
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AI43217
ChemicalName:
3-(Pyrrolidin-2-yl)phenol hydrochloride
CasNumber:
1894060-74-2
MolecularFormula:
C10H14ClNO
MolecularWeight:
199.6773
MdlNumber:
MFCD30471573
Smiles:
Oc1cccc(c1)C1CCCN1.Cl
Complexity:
149
Covalently-bondedUnitCount:
2
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
3
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
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Smiles: CC(=O)CCC(=O)c1ccc(cc1)S(=O)(=O)C
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CC(=O)CCC(=O)c1ccc(cc1)S(=O)(=O)C
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Smiles: O=C(OC(C)(C)C)NCc1nc2c([nH]1)cccc2
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Smiles:
O=C(OC(C)(C)C)NCc1nc2c([nH]1)cccc2
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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