AA21905
1158941-47-9 | 2-(Thiomorpholinomethyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AA21905
ChemicalName
2-(Thiomorpholinomethyl)phenylboronic acid
CasNumber
1158941-47-9
MolecularFormula
C11H16BNO2S
MolecularWeight
237.1262
MdlNumber
MFCD12025994
Smiles
OB(c1ccccc1CN1CCSCC1)O
Complexity
212
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AA21905
ChemicalName: 2-(Thiomorpholinomethyl)phenylboronic acid
CasNumber: 1158941-47-9
MolecularFormula: C11H16BNO2S
MolecularWeight: 237.1262
MdlNumber: MFCD12025994
Smiles: OB(c1ccccc1CN1CCSCC1)O
Complexity: 212
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AA21905
ChemicalName:
2-(Thiomorpholinomethyl)phenylboronic acid
CasNumber:
1158941-47-9
MolecularFormula:
C11H16BNO2S
MolecularWeight:
237.1262
MdlNumber:
MFCD12025994
Smiles:
OB(c1ccccc1CN1CCSCC1)O
Complexity:
212
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AA21907
ChemicalName: 4-Chloro-2-fluoro-6-methoxybenzaldehyde
CasNumber: 1158916-85-8
MolecularFormula: C8H6ClFO2
MolecularWeight: 188.5834
MdlNumber: MFCD24686232
Smiles: COc1cc(Cl)cc(c1C=O)F
Complexity: 165
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
CatalogNumber:
AA21907
ChemicalName:
4-Chloro-2-fluoro-6-methoxybenzaldehyde
CasNumber:
1158916-85-8
MolecularFormula:
C8H6ClFO2
MolecularWeight:
188.5834
MdlNumber:
MFCD24686232
Smiles:
COc1cc(Cl)cc(c1C=O)F
Complexity:
165
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@H]1O[C@H](C[C@@H]1O)n1cc(C#CCNC(=O)C(F)(F)F)c(=O)[nH]c1=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@H]1O[C@H](C[C@@H]1O)n1cc(C#CCNC(=O)C(F)(F)F)c(=O)[nH]c1=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCC#Cc1cn([C@H]2C[C@@H]([C@H](O2)COP(=O)(OP(=O)(OP(=O)(O)O)O)O)O)c(=O)nc1N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCC#Cc1cn([C@H]2C[C@@H]([C@H](O2)COP(=O)(OP(=O)(OP(=O)(O)O)O)O)O)c(=O)nc1N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__