CS-1002399
Palbociclib Impurity 92
Manufacturer: ChemScene
CAS Number: 1974279-40-7
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₆H₃₃N₇O₂
Molecular Weight
475.59
Synonyms
None
SMILES
O=C1C(C(=O)C)=C(C=2C=NC(=NC2N1C3CCCC3)NC4=NC=C(C=C4)N5CCN(CC)CC5)C
Tpsa
96.25
Logp
3.69812
H Acceptors
9
H Donors
1
Rotatable Bonds
6
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₃₃N₇O₂
Molecular Weight: 475.59
Synonyms: None
SMILES: O=C1C(C(=O)C)=C(C=2C=NC(=NC2N1C3CCCC3)NC4=NC=C(C=C4)N5CCN(CC)CC5)C
Tpsa: 96.25
Logp: 3.69812
H Acceptors: 9
H Donors: 1
Rotatable Bonds: 6
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₃₃N₇O₂
Molecular Weight:
475.59
Synonyms:
None
SMILES:
O=C1C(C(=O)C)=C(C=2C=NC(=NC2N1C3CCCC3)NC4=NC=C(C=C4)N5CCN(CC)CC5)C
Tpsa:
96.25
Logp:
3.69812
H Acceptors:
9
H Donors:
1
Rotatable Bonds:
6
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₆BN₃O₂
Molecular Weight: 233.07
Synonyms: None
SMILES: N#CCC(N1N=CC(=C1)B(O)O)C2CCCC2
Tpsa: 82.07
Logp: 0.20788
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 4
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₆BN₃O₂
Molecular Weight:
233.07
Synonyms:
None
SMILES:
N#CCC(N1N=CC(=C1)B(O)O)C2CCCC2
Tpsa:
82.07
Logp:
0.20788
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₄F₂O₆
Molecular Weight: 376.31
Synonyms: None
SMILES: C(OC(=O)C1=CC=CC=C1)[C@H]2[C@H](OC(=O)C3=CC=CC=C3)C(F)(F)C(=O)O2
Tpsa: 78.9
Logp: 2.6297
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₄F₂O₆
Molecular Weight:
376.31
Synonyms:
None
SMILES:
C(OC(=O)C1=CC=CC=C1)[C@H]2[C@H](OC(=O)C3=CC=CC=C3)C(F)(F)C(=O)O2
Tpsa:
78.9
Logp:
2.6297
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₁FO₂
Molecular Weight: 194.20
Synonyms: None
SMILES: FC=1C=C2C(O[C@](CC2)([C@]3(CO3)[H])[H])=CC1
Tpsa: 21.76
Logp: 1.9181
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₁FO₂
Molecular Weight:
194.20
Synonyms:
None
SMILES:
FC=1C=C2C(O[C@](CC2)([C@]3(CO3)[H])[H])=CC1
Tpsa:
21.76
Logp:
1.9181
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1