AC64451
73401-74-8 | 4-(Hydroxymethyl)phenylacetic acid
Manufacturer: A2B Chem
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CatalogNumber
AC64451
ChemicalName
4-(Hydroxymethyl)phenylacetic acid
CasNumber
73401-74-8
MolecularFormula
C9H10O3
MolecularWeight
166.1739
MdlNumber
MFCD00065692
Smiles
OCc1ccc(cc1)CC(=O)O
Complexity
148
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
0.6
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CatalogNumber: AC64451
ChemicalName: 4-(Hydroxymethyl)phenylacetic acid
CasNumber: 73401-74-8
MolecularFormula: C9H10O3
MolecularWeight: 166.1739
MdlNumber: MFCD00065692
Smiles: OCc1ccc(cc1)CC(=O)O
Complexity: 148
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 0.6
CatalogNumber:
AC64451
ChemicalName:
4-(Hydroxymethyl)phenylacetic acid
CasNumber:
73401-74-8
MolecularFormula:
C9H10O3
MolecularWeight:
166.1739
MdlNumber:
MFCD00065692
Smiles:
OCc1ccc(cc1)CC(=O)O
Complexity:
148
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@H]1CSCCN1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@H]1CSCCN1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)c1ccccc(=O)c1O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)c1ccccc(=O)c1O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AC64457
ChemicalName: 5-Bromo-4-nitrobenzo[c][1,2,5]thiadiazole
CasNumber: 72023-79-1
MolecularFormula: C6H2BrN3O2S
MolecularWeight: 260.068
MdlNumber: MFCD00658887
Smiles: [O-][N+](=O)c1c(Br)ccc2c1nsn2
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
AC64457
ChemicalName:
5-Bromo-4-nitrobenzo[c][1,2,5]thiadiazole
CasNumber:
72023-79-1
MolecularFormula:
C6H2BrN3O2S
MolecularWeight:
260.068
MdlNumber:
MFCD00658887
Smiles:
[O-][N+](=O)c1c(Br)ccc2c1nsn2
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3