AB48909
5653-46-3 | 2-Hydroxy-3,4-dimethoxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB48909
ChemicalName
2-Hydroxy-3,4-dimethoxybenzoic acid
CasNumber
5653-46-3
MolecularFormula
C9H10O5
MolecularWeight
198.1727
MdlNumber
MFCD00016498
Smiles
COc1c(OC)ccc(c1O)C(=O)O
NscNumber
37414
Complexity
205
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
1.9
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CatalogNumber: AB48909
ChemicalName: 2-Hydroxy-3,4-dimethoxybenzoic acid
CasNumber: 5653-46-3
MolecularFormula: C9H10O5
MolecularWeight: 198.1727
MdlNumber: MFCD00016498
Smiles: COc1c(OC)ccc(c1O)C(=O)O
NscNumber: 37414
Complexity: 205
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 1.9
CatalogNumber:
AB48909
ChemicalName:
2-Hydroxy-3,4-dimethoxybenzoic acid
CasNumber:
5653-46-3
MolecularFormula:
C9H10O5
MolecularWeight:
198.1727
MdlNumber:
MFCD00016498
Smiles:
COc1c(OC)ccc(c1O)C(=O)O
NscNumber:
37414
Complexity:
205
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccc(cc1)c1ccc2c(c1)c1cc(ccc1[nH]2)c1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1ccc(cc1)c1ccc2c(c1)c1cc(ccc1[nH]2)c1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB48911
ChemicalName: (R)-2-Phenylpyrrolidine
CasNumber: 56523-47-8
MolecularFormula: C10H13N
MolecularWeight: 147.2169
MdlNumber: MFCD06762513
Smiles: C1CN[C@H](C1)c1ccccc1
NscNumber: __
Complexity: 116
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AB48911
ChemicalName:
(R)-2-Phenylpyrrolidine
CasNumber:
56523-47-8
MolecularFormula:
C10H13N
MolecularWeight:
147.2169
MdlNumber:
MFCD06762513
Smiles:
C1CN[C@H](C1)c1ccccc1
NscNumber:
__
Complexity:
116
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCCN1CCCCC1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCCN1CCCCC1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__