AI41468
18385-77-8 | 6-Bromo-3,4-dihydro-2h-1-benzopyran-4-ol
Manufacturer: A2B Chem
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CatalogNumber
AI41468
ChemicalName
6-Bromo-3,4-dihydro-2h-1-benzopyran-4-ol
CasNumber
18385-77-8
MolecularFormula
C9H9BrO2
MolecularWeight
229.0706
MdlNumber
MFCD11899784
Smiles
Brc1ccc2c(c1)C(O)CCO2
Complexity
163
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
1.9
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CatalogNumber: AI41468
ChemicalName: 6-Bromo-3,4-dihydro-2h-1-benzopyran-4-ol
CasNumber: 18385-77-8
MolecularFormula: C9H9BrO2
MolecularWeight: 229.0706
MdlNumber: MFCD11899784
Smiles: Brc1ccc2c(c1)C(O)CCO2
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.9
CatalogNumber:
AI41468
ChemicalName:
6-Bromo-3,4-dihydro-2h-1-benzopyran-4-ol
CasNumber:
18385-77-8
MolecularFormula:
C9H9BrO2
MolecularWeight:
229.0706
MdlNumber:
MFCD11899784
Smiles:
Brc1ccc2c(c1)C(O)CCO2
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.9
CatalogNumber: AI41469
ChemicalName: 7-Bromochroman-4-ol
CasNumber: 18385-82-5
MolecularFormula: C9H9BrO2
MolecularWeight: 229.0706
MdlNumber: MFCD23806968
Smiles: Brc1ccc2c(c1)OCCC2O
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.9
CatalogNumber:
AI41469
ChemicalName:
7-Bromochroman-4-ol
CasNumber:
18385-82-5
MolecularFormula:
C9H9BrO2
MolecularWeight:
229.0706
MdlNumber:
MFCD23806968
Smiles:
Brc1ccc2c(c1)OCCC2O
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.9
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Smiles: OC(=O)c1ccc2c(c1)nc1n2CCCC1
Complexity: __
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Smiles:
OC(=O)c1ccc2c(c1)nc1n2CCCC1
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UndefinedAtomStereocenterCount:
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Smiles: C=CCNC(=S)NNC(=O)C
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
C=CCNC(=S)NNC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__