AB46314
480-91-1 | 2,3-Dihydroisoindol-1-one
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AB46314
ChemicalName
2,3-Dihydroisoindol-1-one
CasNumber
480-91-1
MolecularFormula
C8H7NO
MolecularWeight
133.1473
MdlNumber
MFCD03085939
Smiles
O=C1NCc2c1cccc2
NscNumber
3689
Complexity
155
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
Xlogp3
0.8
Compare Similar Items
Show Difference
CatalogNumber: AB46314
ChemicalName: 2,3-Dihydroisoindol-1-one
CasNumber: 480-91-1
MolecularFormula: C8H7NO
MolecularWeight: 133.1473
MdlNumber: MFCD03085939
Smiles: O=C1NCc2c1cccc2
NscNumber: 3689
Complexity: 155
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
Xlogp3: 0.8
CatalogNumber:
AB46314
ChemicalName:
2,3-Dihydroisoindol-1-one
CasNumber:
480-91-1
MolecularFormula:
C8H7NO
MolecularWeight:
133.1473
MdlNumber:
MFCD03085939
Smiles:
O=C1NCc2c1cccc2
NscNumber:
3689
Complexity:
155
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
Xlogp3:
0.8
CatalogNumber: AB46315
ChemicalName: (3R,3aR,6R,6aR)-Hexahydrofuro[3,2-b]furan-3,6-diol
CasNumber: 641-74-7
MolecularFormula: C6H10O4
MolecularWeight: 146.1412
MdlNumber: MFCD10698761
Smiles: O[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2O
NscNumber: __
Complexity: 122
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
Xlogp3: -1.4
CatalogNumber:
AB46315
ChemicalName:
(3R,3aR,6R,6aR)-Hexahydrofuro[3,2-b]furan-3,6-diol
CasNumber:
641-74-7
MolecularFormula:
C6H10O4
MolecularWeight:
146.1412
MdlNumber:
MFCD10698761
Smiles:
O[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2O
NscNumber:
__
Complexity:
122
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
Xlogp3:
-1.4
CatalogNumber: AB46316
ChemicalName: isonicotinic acid
CasNumber: 55-22-1
MolecularFormula: C6H5NO2
MolecularWeight: 123.10940000000001
MdlNumber: MFCD00006429
Smiles: OC(=O)c1ccncc1
NscNumber: 1483
Complexity: 108
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
Xlogp3: 0.4
CatalogNumber:
AB46316
ChemicalName:
isonicotinic acid
CasNumber:
55-22-1
MolecularFormula:
C6H5NO2
MolecularWeight:
123.10940000000001
MdlNumber:
MFCD00006429
Smiles:
OC(=O)c1ccncc1
NscNumber:
1483
Complexity:
108
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=N)c1ccncc1.[Cl-]
NscNumber: __
Complexity: 105
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=N)c1ccncc1.[Cl-]
NscNumber:
__
Complexity:
105
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__