AF87748
355022-20-7 | 3-Amino-4-(isopropylamino)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AF87748
ChemicalName
3-Amino-4-(isopropylamino)benzonitrile
CasNumber
355022-20-7
MolecularFormula
C10H13N3
MolecularWeight
175.2303
MdlNumber
MFCD09031713
Smiles
N#Cc1ccc(c(c1)N)NC(C)C
Complexity
204
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.7
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CatalogNumber: AF87748
ChemicalName: 3-Amino-4-(isopropylamino)benzonitrile
CasNumber: 355022-20-7
MolecularFormula: C10H13N3
MolecularWeight: 175.2303
MdlNumber: MFCD09031713
Smiles: N#Cc1ccc(c(c1)N)NC(C)C
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AF87748
ChemicalName:
3-Amino-4-(isopropylamino)benzonitrile
CasNumber:
355022-20-7
MolecularFormula:
C10H13N3
MolecularWeight:
175.2303
MdlNumber:
MFCD09031713
Smiles:
N#Cc1ccc(c(c1)N)NC(C)C
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCn1cnc2c1ccc(c2)C(=O)O
Complexity: 245
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCn1cnc2c1ccc(c2)C(=O)O
Complexity:
245
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.8
CatalogNumber: AF87750
ChemicalName: 1-Bromo-4-(cyclopropylmethoxy)benzene
CasNumber: 412004-56-9
MolecularFormula: C10H11BrO
MolecularWeight: 227.0977
MdlNumber: MFCD12138829
Smiles: Brc1ccc(cc1)OCC1CC1
Complexity: 137
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 3.3
CatalogNumber:
AF87750
ChemicalName:
1-Bromo-4-(cyclopropylmethoxy)benzene
CasNumber:
412004-56-9
MolecularFormula:
C10H11BrO
MolecularWeight:
227.0977
MdlNumber:
MFCD12138829
Smiles:
Brc1ccc(cc1)OCC1CC1
Complexity:
137
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
3.3
CatalogNumber: AF87751
ChemicalName: 2-Amino-4-bromo-6-methylphenol
CasNumber: 343269-52-3
MolecularFormula: C7H8BrNO
MolecularWeight: 202.0485
MdlNumber: MFCD18294016
Smiles: Brc1cc(C)c(c(c1)N)O
Complexity: 120
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: __
Xlogp3: 1.1
CatalogNumber:
AF87751
ChemicalName:
2-Amino-4-bromo-6-methylphenol
CasNumber:
343269-52-3
MolecularFormula:
C7H8BrNO
MolecularWeight:
202.0485
MdlNumber:
MFCD18294016
Smiles:
Brc1cc(C)c(c(c1)N)O
Complexity:
120
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
__
Xlogp3:
1.1