AB92877
887350-84-7 | Methyl 1-cyclopropylbenzotriazole-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB92877
ChemicalName
Methyl 1-cyclopropylbenzotriazole-5-carboxylate
CasNumber
887350-84-7
MolecularFormula
C11H11N3O2
MolecularWeight
217.2239
MdlNumber
MFCD08448264
Smiles
COC(=O)c1ccc2c(c1)nnn2C1CC1
Complexity
293
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
1.7
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CatalogNumber: AB92877
ChemicalName: Methyl 1-cyclopropylbenzotriazole-5-carboxylate
CasNumber: 887350-84-7
MolecularFormula: C11H11N3O2
MolecularWeight: 217.2239
MdlNumber: MFCD08448264
Smiles: COC(=O)c1ccc2c(c1)nnn2C1CC1
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1.7
CatalogNumber:
AB92877
ChemicalName:
Methyl 1-cyclopropylbenzotriazole-5-carboxylate
CasNumber:
887350-84-7
MolecularFormula:
C11H11N3O2
MolecularWeight:
217.2239
MdlNumber:
MFCD08448264
Smiles:
COC(=O)c1ccc2c(c1)nnn2C1CC1
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1.7
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Smiles: COc1ccc(cc1)C1NCCSC1
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Smiles:
COc1ccc(cc1)C1NCCSC1
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: O=C(N1CCCC(C1)(Cc1ccc(cc1)C(F)(F)F)C(=O)O)OC(C)(C)C
Complexity: __
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Smiles:
O=C(N1CCCC(C1)(Cc1ccc(cc1)C(F)(F)F)C(=O)O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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