AE42549
1400264-85-8 | tert-Butyl 3,3-difluoro-4-oxopiperidine-1-carboxylate hydrate
Manufacturer: A2B Chem
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CatalogNumber
AE42549
ChemicalName
tert-Butyl 3,3-difluoro-4-oxopiperidine-1-carboxylate hydrate
CasNumber
1400264-85-8
MolecularFormula
C10H17F2NO4
MolecularWeight
253.24308639999998
MdlNumber
MFCD16140378
Smiles
O=C(N1CCC(=O)C(C1)(F)F)OC(C)(C)C.O
Complexity
310
Covalently-bondedUnitCount
2
HeavyAtomCount
17
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
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CatalogNumber: AE42549
ChemicalName: tert-Butyl 3,3-difluoro-4-oxopiperidine-1-carboxylate hydrate
CasNumber: 1400264-85-8
MolecularFormula: C10H17F2NO4
MolecularWeight: 253.24308639999998
MdlNumber: MFCD16140378
Smiles: O=C(N1CCC(=O)C(C1)(F)F)OC(C)(C)C.O
Complexity: 310
Covalently-bondedUnitCount: 2
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AE42549
ChemicalName:
tert-Butyl 3,3-difluoro-4-oxopiperidine-1-carboxylate hydrate
CasNumber:
1400264-85-8
MolecularFormula:
C10H17F2NO4
MolecularWeight:
253.24308639999998
MdlNumber:
MFCD16140378
Smiles:
O=C(N1CCC(=O)C(C1)(F)F)OC(C)(C)C.O
Complexity:
310
Covalently-bondedUnitCount:
2
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: AE42550
ChemicalName: 5-Chloro-3-iodo-1h-pyrazolo[4,3-b]pyridine
CasNumber: 1357945-27-7
MolecularFormula: C6H3ClIN3
MolecularWeight: 279.4656
MdlNumber: MFCD16658104
Smiles: Clc1ccc2c(n1)c(I)n[nH]2
Complexity: 157
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
CatalogNumber:
AE42550
ChemicalName:
5-Chloro-3-iodo-1h-pyrazolo[4,3-b]pyridine
CasNumber:
1357945-27-7
MolecularFormula:
C6H3ClIN3
MolecularWeight:
279.4656
MdlNumber:
MFCD16658104
Smiles:
Clc1ccc2c(n1)c(I)n[nH]2
Complexity:
157
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccnc(n1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccnc(n1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AE42552
ChemicalName: (S)-1-(3,5-Difluorophenyl)ethanamine hydrochloride
CasNumber: 1213128-98-3
MolecularFormula: C8H10ClF2N
MolecularWeight: 193.6215
MdlNumber: MFCD11101247
Smiles: C[C@@H](c1cc(F)cc(c1)F)N.Cl
Complexity: 119
Covalently-bondedUnitCount: 2
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AE42552
ChemicalName:
(S)-1-(3,5-Difluorophenyl)ethanamine hydrochloride
CasNumber:
1213128-98-3
MolecularFormula:
C8H10ClF2N
MolecularWeight:
193.6215
MdlNumber:
MFCD11101247
Smiles:
C[C@@H](c1cc(F)cc(c1)F)N.Cl
Complexity:
119
Covalently-bondedUnitCount:
2
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1