AI09755
1152622-73-5 | 3-(Chloromethyl)-N-isopropylbenzamide
Manufacturer: A2B Chem
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CatalogNumber
AI09755
ChemicalName
3-(Chloromethyl)-N-isopropylbenzamide
CasNumber
1152622-73-5
MolecularFormula
C11H14ClNO
MolecularWeight
211.688
MdlNumber
MFCD11104977
Smiles
ClCc1cccc(c1)C(=O)NC(C)C
Complexity
194
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.4
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CatalogNumber: AI09755
ChemicalName: 3-(Chloromethyl)-N-isopropylbenzamide
CasNumber: 1152622-73-5
MolecularFormula: C11H14ClNO
MolecularWeight: 211.688
MdlNumber: MFCD11104977
Smiles: ClCc1cccc(c1)C(=O)NC(C)C
Complexity: 194
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AI09755
ChemicalName:
3-(Chloromethyl)-N-isopropylbenzamide
CasNumber:
1152622-73-5
MolecularFormula:
C11H14ClNO
MolecularWeight:
211.688
MdlNumber:
MFCD11104977
Smiles:
ClCc1cccc(c1)C(=O)NC(C)C
Complexity:
194
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(C)OC1=CC=C(C=C1)C(=O)C2CC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(C)OC1=CC=C(C=C1)C(=O)C2CC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cc(ccc1n1cccn1)C(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cc(ccc1n1cccn1)C(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cnn(c1C1CC1)c1ccccn1
Complexity: 306
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cnn(c1C1CC1)c1ccccn1
Complexity:
306
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.3