AC74614
766-68-7 | (Z)-3-Cyclopropylbut-2-enoic acid
Manufacturer: A2B Chem
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CatalogNumber
AC74614
ChemicalName
(Z)-3-Cyclopropylbut-2-enoic acid
CasNumber
766-68-7
MolecularFormula
C7H10O2
MolecularWeight
126.1531
MdlNumber
MFCD12756435
Smiles
C/C(=C/C(=O)O)/C1CC1
Complexity
154
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedBondStereocenterCount
1
Xlogp3
1.8
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CatalogNumber: AC74614
ChemicalName: (Z)-3-Cyclopropylbut-2-enoic acid
CasNumber: 766-68-7
MolecularFormula: C7H10O2
MolecularWeight: 126.1531
MdlNumber: MFCD12756435
Smiles: C/C(=C/C(=O)O)/C1CC1
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedBondStereocenterCount: 1
Xlogp3: 1.8
CatalogNumber:
AC74614
ChemicalName:
(Z)-3-Cyclopropylbut-2-enoic acid
CasNumber:
766-68-7
MolecularFormula:
C7H10O2
MolecularWeight:
126.1531
MdlNumber:
MFCD12756435
Smiles:
C/C(=C/C(=O)O)/C1CC1
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedBondStereocenterCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: Clc1cc(N=Cc2ccc(cc2)[N+](=O)[O-])cc(c1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
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Smiles:
Clc1cc(N=Cc2ccc(cc2)[N+](=O)[O-])cc(c1)Cl
Complexity:
__
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__
HeavyAtomCount:
__
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RotatableBondCount:
__
UndefinedBondStereocenterCount:
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Xlogp3:
__
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MdlNumber: __
Smiles: C#CCN1CCCC1=O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
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__
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
C#CCN1CCCC1=O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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UndefinedBondStereocenterCount:
__
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__
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Smiles: O[C@@H]1[C@@H]2OP(=O)(O)OC[C@H]2O[C@H]1n1cnc2c1nc(N)[nH]c2=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O[C@@H]1[C@@H]2OP(=O)(O)OC[C@H]2O[C@H]1n1cnc2c1nc(N)[nH]c2=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
__