AE34372
122416-41-5 | 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethanamine
Manufacturer: A2B Chem
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CatalogNumber
AE34372
ChemicalName
1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethanamine
CasNumber
122416-41-5
MolecularFormula
C10H13NO2
MolecularWeight
179.2157
MdlNumber
MFCD01312297
Smiles
CC(c1ccc2c(c1)OCCO2)N
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
1.1
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CatalogNumber: AE34372
ChemicalName: 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethanamine
CasNumber: 122416-41-5
MolecularFormula: C10H13NO2
MolecularWeight: 179.2157
MdlNumber: MFCD01312297
Smiles: CC(c1ccc2c(c1)OCCO2)N
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.1
CatalogNumber:
AE34372
ChemicalName:
1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethanamine
CasNumber:
122416-41-5
MolecularFormula:
C10H13NO2
MolecularWeight:
179.2157
MdlNumber:
MFCD01312297
Smiles:
CC(c1ccc2c(c1)OCCO2)N
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.1
CatalogNumber: __
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Smiles: COc1cc(OC)ccc1N1CC(CC1=O)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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Smiles:
COc1cc(OC)ccc1N1CC(CC1=O)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Xlogp3:
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MolecularFormula: __
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MdlNumber: __
Smiles: NC(=O)NC(C(=O)O)C(O)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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__
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__
MolecularFormula:
__
MolecularWeight:
__
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Smiles:
NC(=O)NC(C(=O)O)C(O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(N)ccc1n1cccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(N)ccc1n1cccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__