AB33680
2904-41-8 | Tris(2-carboxyethyl) isocyanurate
Manufacturer: A2B Chem
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CatalogNumber
AB33680
ChemicalName
Tris(2-carboxyethyl) isocyanurate
CasNumber
2904-41-8
MolecularFormula
C12H15N3O9
MolecularWeight
345.2622
MdlNumber
MFCD00059790
Smiles
OC(=O)CCn1c(=O)n(CCC(=O)O)c(=O)n(c1=O)CCC(=O)O
NscNumber
11694
Complexity
484
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
9
HydrogenBondDonorCount
3
RotatableBondCount
9
Xlogp3
-2.1
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CatalogNumber: AB33680
ChemicalName: Tris(2-carboxyethyl) isocyanurate
CasNumber: 2904-41-8
MolecularFormula: C12H15N3O9
MolecularWeight: 345.2622
MdlNumber: MFCD00059790
Smiles: OC(=O)CCn1c(=O)n(CCC(=O)O)c(=O)n(c1=O)CCC(=O)O
NscNumber: 11694
Complexity: 484
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 9
HydrogenBondDonorCount: 3
RotatableBondCount: 9
Xlogp3: -2.1
CatalogNumber:
AB33680
ChemicalName:
Tris(2-carboxyethyl) isocyanurate
CasNumber:
2904-41-8
MolecularFormula:
C12H15N3O9
MolecularWeight:
345.2622
MdlNumber:
MFCD00059790
Smiles:
OC(=O)CCn1c(=O)n(CCC(=O)O)c(=O)n(c1=O)CCC(=O)O
NscNumber:
11694
Complexity:
484
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
9
HydrogenBondDonorCount:
3
RotatableBondCount:
9
Xlogp3:
-2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCn1c(=O)[nH]c(=O)n(c1=O)CCC(=O)O
NscNumber: __
Complexity: 409
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -1.8
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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MdlNumber:
__
Smiles:
OC(=O)CCn1c(=O)[nH]c(=O)n(c1=O)CCC(=O)O
NscNumber:
__
Complexity:
409
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CCCn1c(=O)n(CCC#N)c(=O)n(c1=O)CCC#N
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Complexity: __
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MolecularFormula:
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Smiles:
N#CCCn1c(=O)n(CCC#N)c(=O)n(c1=O)CCC#N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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MdlNumber: __
Smiles: ONC(=N)N1CCOCC1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ONC(=N)N1CCOCC1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__