AA35730
1261269-01-5 | Ethyl 3-amino-5-chlorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA35730
ChemicalName
Ethyl 3-amino-5-chlorobenzoate
CasNumber
1261269-01-5
MolecularFormula
C9H10ClNO2
MolecularWeight
199.6342
MdlNumber
MFCD17276491
Smiles
CCOC(=O)c1cc(N)cc(c1)Cl
Complexity
187
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.1
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CatalogNumber: AA35730
ChemicalName: Ethyl 3-amino-5-chlorobenzoate
CasNumber: 1261269-01-5
MolecularFormula: C9H10ClNO2
MolecularWeight: 199.6342
MdlNumber: MFCD17276491
Smiles: CCOC(=O)c1cc(N)cc(c1)Cl
Complexity: 187
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AA35730
ChemicalName:
Ethyl 3-amino-5-chlorobenzoate
CasNumber:
1261269-01-5
MolecularFormula:
C9H10ClNO2
MolecularWeight:
199.6342
MdlNumber:
MFCD17276491
Smiles:
CCOC(=O)c1cc(N)cc(c1)Cl
Complexity:
187
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.1
CatalogNumber: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: O=C(C1CC1)Nc1ccc2c(c1)[nH]c(n2)c1ccc(cc1)NC(=O)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
O=C(C1CC1)Nc1ccc2c(c1)[nH]c(n2)c1ccc(cc1)NC(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: Fc1ccc(cc1C(F)(F)F)c1n[nH]nn1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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Smiles:
Fc1ccc(cc1C(F)(F)F)c1n[nH]nn1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccccc1c1cnco1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccccc1c1cnco1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__