AB43659
99584-96-0 | 2,5-Dibromohexanediamide
Manufacturer: A2B Chem
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CatalogNumber
AB43659
ChemicalName
2,5-Dibromohexanediamide
CasNumber
99584-96-0
MolecularFormula
C6H10Br2N2O2
MolecularWeight
301.9638
MdlNumber
MFCD27976335
Smiles
BrC(C(=O)N)CCC(C(=O)N)Br
NscNumber
126275
Complexity
166
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
5
UndefinedAtomStereocenterCount
2
Xlogp3
0.4
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CatalogNumber: AB43659
ChemicalName: 2,5-Dibromohexanediamide
CasNumber: 99584-96-0
MolecularFormula: C6H10Br2N2O2
MolecularWeight: 301.9638
MdlNumber: MFCD27976335
Smiles: BrC(C(=O)N)CCC(C(=O)N)Br
NscNumber: 126275
Complexity: 166
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 2
Xlogp3: 0.4
CatalogNumber:
AB43659
ChemicalName:
2,5-Dibromohexanediamide
CasNumber:
99584-96-0
MolecularFormula:
C6H10Br2N2O2
MolecularWeight:
301.9638
MdlNumber:
MFCD27976335
Smiles:
BrC(C(=O)N)CCC(C(=O)N)Br
NscNumber:
126275
Complexity:
166
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
2
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(cn1)Br
NscNumber: __
Complexity: 76.8
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(cn1)Br
NscNumber:
__
Complexity:
76.8
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.6
CatalogNumber: AB43661
ChemicalName: 2,5-Dichloro-4,6-dimethylnicotinonitrile
CasNumber: 91591-63-8
MolecularFormula: C8H6Cl2N2
MolecularWeight: 201.0526
MdlNumber: MFCD00052631
Smiles: N#Cc1c(Cl)nc(c(c1C)Cl)C
NscNumber: 341973
Complexity: 210
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 2.9
CatalogNumber:
AB43661
ChemicalName:
2,5-Dichloro-4,6-dimethylnicotinonitrile
CasNumber:
91591-63-8
MolecularFormula:
C8H6Cl2N2
MolecularWeight:
201.0526
MdlNumber:
MFCD00052631
Smiles:
N#Cc1c(Cl)nc(c(c1C)Cl)C
NscNumber:
341973
Complexity:
210
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc(c(c1)C(=O)O)Cl
NscNumber: __
Complexity: 161
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc(c(c1)C(=O)O)Cl
NscNumber:
__
Complexity:
161
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.8