AB51580
5090-29-9 | 2-Amino-1-(3,4-dihydroxyphenyl)ethan-1-one hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AB51580
ChemicalName
2-Amino-1-(3,4-dihydroxyphenyl)ethan-1-one hydrochloride
CasNumber
5090-29-9
MolecularFormula
C8H10ClNO3
MolecularWeight
203.6229
MdlNumber
MFCD00522692
Smiles
NCC(=O)c1ccc(c(c1)O)O.Cl
NscNumber
23319
Complexity
172
Covalently-bondedUnitCount
2
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
4
RotatableBondCount
2
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CatalogNumber: AB51580
ChemicalName: 2-Amino-1-(3,4-dihydroxyphenyl)ethan-1-one hydrochloride
CasNumber: 5090-29-9
MolecularFormula: C8H10ClNO3
MolecularWeight: 203.6229
MdlNumber: MFCD00522692
Smiles: NCC(=O)c1ccc(c(c1)O)O.Cl
NscNumber: 23319
Complexity: 172
Covalently-bondedUnitCount: 2
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 4
RotatableBondCount: 2
CatalogNumber:
AB51580
ChemicalName:
2-Amino-1-(3,4-dihydroxyphenyl)ethan-1-one hydrochloride
CasNumber:
5090-29-9
MolecularFormula:
C8H10ClNO3
MolecularWeight:
203.6229
MdlNumber:
MFCD00522692
Smiles:
NCC(=O)c1ccc(c(c1)O)O.Cl
NscNumber:
23319
Complexity:
172
Covalently-bondedUnitCount:
2
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
4
RotatableBondCount:
2
CatalogNumber: __
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Smiles: Oc1cc2O[C@H](c3ccc(c(c3)O)O)[C@H](C(=O)c2c(c1)O)O
NscNumber: __
Complexity: 428
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Smiles:
Oc1cc2O[C@H](c3ccc(c(c3)O)O)[C@H](C(=O)c2c(c1)O)O
NscNumber:
__
Complexity:
428
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Smiles: CCCCCCCCOc1cc2-c3ccccc3C(=O)c3c2c2c1c1c(OCCCCCCCC)cc4-c5ccccc5C(=O)c5c4c1c(c2cc3)cc5
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Smiles:
CCCCCCCCOc1cc2-c3ccccc3C(=O)c3c2c2c1c1c(OCCCCCCCC)cc4-c5ccccc5C(=O)c5c4c1c(c2cc3)cc5
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Smiles: C1NC2CC1C2.Cl
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Smiles:
C1NC2CC1C2.Cl
NscNumber:
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Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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