AB50324
2435-36-1 | Dimethyl cyclopentane-1,3-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB50324
ChemicalName
Dimethyl cyclopentane-1,3-dicarboxylate
CasNumber
2435-36-1
MolecularFormula
C9H14O4
MolecularWeight
186.2051
MdlNumber
MFCD01735429
Smiles
COC(=O)C1CCC(C1)C(=O)OC
Complexity
190
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
4
UndefinedAtomStereocenterCount
2
Xlogp3
0.8
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CatalogNumber: AB50324
ChemicalName: Dimethyl cyclopentane-1,3-dicarboxylate
CasNumber: 2435-36-1
MolecularFormula: C9H14O4
MolecularWeight: 186.2051
MdlNumber: MFCD01735429
Smiles: COC(=O)C1CCC(C1)C(=O)OC
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 2
Xlogp3: 0.8
CatalogNumber:
AB50324
ChemicalName:
Dimethyl cyclopentane-1,3-dicarboxylate
CasNumber:
2435-36-1
MolecularFormula:
C9H14O4
MolecularWeight:
186.2051
MdlNumber:
MFCD01735429
Smiles:
COC(=O)C1CCC(C1)C(=O)OC
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
2
Xlogp3:
0.8
CatalogNumber: AB50325
ChemicalName: Ethyl 3-amino-1H-pyrrole-2-carboxylate
CasNumber: 252932-48-2
MolecularFormula: C7H10N2O2
MolecularWeight: 154.1665
MdlNumber: MFCD06797655
Smiles: CCOC(=O)c1[nH]ccc1N
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: 1.1
CatalogNumber:
AB50325
ChemicalName:
Ethyl 3-amino-1H-pyrrole-2-carboxylate
CasNumber:
252932-48-2
MolecularFormula:
C7H10N2O2
MolecularWeight:
154.1665
MdlNumber:
MFCD06797655
Smiles:
CCOC(=O)c1[nH]ccc1N
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.1
CatalogNumber: AB50326
ChemicalName: Chir-99021
CasNumber: 252917-06-9
MolecularFormula: C22H18Cl2N8
MolecularWeight: 465.3379
MdlNumber: MFCD11846251
Smiles: N#Cc1ccc(nc1)NCCNc1ncc(c(n1)c1ccc(cc1Cl)Cl)c1[nH]cc(n1)C
Complexity: 645
Covalently-bondedUnitCount: 1
HeavyAtomCount: 32
HydrogenBondAcceptorCount: 7
RotatableBondCount: 7
UndefinedAtomStereocenterCount: __
Xlogp3: 4.3
CatalogNumber:
AB50326
ChemicalName:
Chir-99021
CasNumber:
252917-06-9
MolecularFormula:
C22H18Cl2N8
MolecularWeight:
465.3379
MdlNumber:
MFCD11846251
Smiles:
N#Cc1ccc(nc1)NCCNc1ncc(c(n1)c1ccc(cc1Cl)Cl)c1[nH]cc(n1)C
Complexity:
645
Covalently-bondedUnitCount:
1
HeavyAtomCount:
32
HydrogenBondAcceptorCount:
7
RotatableBondCount:
7
UndefinedAtomStereocenterCount:
__
Xlogp3:
4.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCOP(=O)(Oc1ccccc1)OCCCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCOP(=O)(Oc1ccccc1)OCCCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__