AI44040
1956324-43-8 | 3-Amino-3-(3-methoxyphenyl)propanenitrile hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AI44040
ChemicalName
3-Amino-3-(3-methoxyphenyl)propanenitrile hydrochloride
CasNumber
1956324-43-8
MolecularFormula
C10H13ClN2O
MolecularWeight
212.676
MdlNumber
MFCD30180244
Smiles
N#CCC(c1cccc(c1)OC)N.Cl
Complexity
196
Covalently-bondedUnitCount
2
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
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CatalogNumber: AI44040
ChemicalName: 3-Amino-3-(3-methoxyphenyl)propanenitrile hydrochloride
CasNumber: 1956324-43-8
MolecularFormula: C10H13ClN2O
MolecularWeight: 212.676
MdlNumber: MFCD30180244
Smiles: N#CCC(c1cccc(c1)OC)N.Cl
Complexity: 196
Covalently-bondedUnitCount: 2
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AI44040
ChemicalName:
3-Amino-3-(3-methoxyphenyl)propanenitrile hydrochloride
CasNumber:
1956324-43-8
MolecularFormula:
C10H13ClN2O
MolecularWeight:
212.676
MdlNumber:
MFCD30180244
Smiles:
N#CCC(c1cccc(c1)OC)N.Cl
Complexity:
196
Covalently-bondedUnitCount:
2
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
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MolecularFormula: __
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Smiles: COC(=O)c1ncc(c(c1)NC(=O)OC(C)(C)C)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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Smiles:
COC(=O)c1ncc(c(c1)NC(=O)OC(C)(C)C)F
Complexity:
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HeavyAtomCount:
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Smiles: OCc1cnncc1C
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Smiles:
OCc1cnncc1C
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HydrogenBondDonorCount:
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UndefinedAtomStereocenterCount:
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Smiles: COC1=CC(=C(N=C1OC)I)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COC1=CC(=C(N=C1OC)I)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__