AX55320

2096998-08-0 | 1-(4-Nitrophenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea

Manufacturer: A2B Chem

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CatalogNumber

AX55320

ChemicalName

1-(4-Nitrophenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea

CasNumber

2096998-08-0

MolecularFormula

C19H22BN3O5

MolecularWeight

383.2061

MdlNumber

MFCD20231472

Smiles

O=C(Nc1ccc(cc1)[N+](=O)[O-])Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C

Complexity

571

Covalently-bondedUnitCount

1

HeavyAtomCount

28

HydrogenBondAcceptorCount

5

HydrogenBondDonorCount

2

RotatableBondCount

3

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A2B Chem

AX55320

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CatalogNumber:
AX55320

ChemicalName:
1-(4-Nitrophenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea

CasNumber:
2096998-08-0

MolecularFormula:
C19H22BN3O5

MolecularWeight:
383.2061

MdlNumber:
MFCD20231472

Smiles:
O=C(Nc1ccc(cc1)[N+](=O)[O-])Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C

Complexity:
571

Covalently-bondedUnitCount:
1

HeavyAtomCount:
28

HydrogenBondAcceptorCount:
5

HydrogenBondDonorCount:
2

RotatableBondCount:
3

Img

A2B Chem

AX55321

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CatalogNumber:
AX55321

ChemicalName:
2-Amino-5-cyanophenylboronic acid pinacol ester

CasNumber:
1315350-04-9

MolecularFormula:
C13H17BN2O2

MolecularWeight:
244.0973

MdlNumber:
MFCD12025487

Smiles:
N#Cc1ccc(c(c1)B1OC(C(O1)(C)C)(C)C)N

Complexity:
358

Covalently-bondedUnitCount:
1

HeavyAtomCount:
18

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
1

RotatableBondCount:
1

Img

A2B Chem

AX55322

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CatalogNumber:
AX55322

ChemicalName:
2-Chloro-5-(pyrrolidinomethyl)phenylboronic acid, pinacol ester

CasNumber:
2096333-77-4

MolecularFormula:
C17H25BClNO2

MolecularWeight:
321.6499

MdlNumber:
MFCD18783189

Smiles:
Clc1ccc(cc1B1OC(C(O1)(C)C)(C)C)CN1CCCC1

Complexity:
382

Covalently-bondedUnitCount:
1

HeavyAtomCount:
22

HydrogenBondAcceptorCount:
3

HydrogenBondDonorCount:
__

RotatableBondCount:
3

Img

A2B Chem

AX55323

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CatalogNumber:
AX55323

ChemicalName:
3-Chloro-2-propoxypyridine-4-boronic acid

CasNumber:
2096341-56-7

MolecularFormula:
C8H11BClNO3

MolecularWeight:
215.4418

MdlNumber:
MFCD18434422

Smiles:
CCCOc1nccc(c1Cl)B(O)O

Complexity:
173

Covalently-bondedUnitCount:
1

HeavyAtomCount:
14

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
2

RotatableBondCount:
4