AB67326
876-31-3 | 4-(Cyanomethyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB67326
ChemicalName
4-(Cyanomethyl)benzonitrile
CasNumber
876-31-3
MolecularFormula
C9H6N2
MolecularWeight
142.15734
MdlNumber
MFCD00060305
Smiles
N#CCc1ccc(cc1)C#N
NscNumber
97215
Complexity
206
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
1.6
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CatalogNumber: AB67326
ChemicalName: 4-(Cyanomethyl)benzonitrile
CasNumber: 876-31-3
MolecularFormula: C9H6N2
MolecularWeight: 142.15734
MdlNumber: MFCD00060305
Smiles: N#CCc1ccc(cc1)C#N
NscNumber: 97215
Complexity: 206
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AB67326
ChemicalName:
4-(Cyanomethyl)benzonitrile
CasNumber:
876-31-3
MolecularFormula:
C9H6N2
MolecularWeight:
142.15734
MdlNumber:
MFCD00060305
Smiles:
N#CCc1ccc(cc1)C#N
NscNumber:
97215
Complexity:
206
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: AB67327
ChemicalName: 4-Cyanophenylthiourea
CasNumber: 3460-55-7
MolecularFormula: C8H7N3S
MolecularWeight: 177.2263
MdlNumber: MFCD00041175
Smiles: N#Cc1ccc(cc1)NC(=S)N
NscNumber: __
Complexity: 210
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 1.4
CatalogNumber:
AB67327
ChemicalName:
4-Cyanophenylthiourea
CasNumber:
3460-55-7
MolecularFormula:
C8H7N3S
MolecularWeight:
177.2263
MdlNumber:
MFCD00041175
Smiles:
N#Cc1ccc(cc1)NC(=S)N
NscNumber:
__
Complexity:
210
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
1.4
CatalogNumber: AB67328
ChemicalName: Piperidine-4-carbonitrile
CasNumber: 4395-98-6
MolecularFormula: C6H10N2
MolecularWeight: 110.157
MdlNumber: MFCD05022468
Smiles: N#CC1CCNCC1
NscNumber: __
Complexity: 105
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB67328
ChemicalName:
Piperidine-4-carbonitrile
CasNumber:
4395-98-6
MolecularFormula:
C6H10N2
MolecularWeight:
110.157
MdlNumber:
MFCD05022468
Smiles:
N#CC1CCNCC1
NscNumber:
__
Complexity:
105
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB67330
ChemicalName: 4-Cyanopyridine-3-boronic acid pinacol ester
CasNumber: 878194-91-3
MolecularFormula: C12H15BN2O2
MolecularWeight: 230.0707
MdlNumber: MFCD08458478
Smiles: N#Cc1ccncc1B1OC(C(O1)(C)C)(C)C
NscNumber: __
Complexity: 332
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB67330
ChemicalName:
4-Cyanopyridine-3-boronic acid pinacol ester
CasNumber:
878194-91-3
MolecularFormula:
C12H15BN2O2
MolecularWeight:
230.0707
MdlNumber:
MFCD08458478
Smiles:
N#Cc1ccncc1B1OC(C(O1)(C)C)(C)C
NscNumber:
__
Complexity:
332
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
__