CS-1002109
Pemetrexed Impurity 71
Manufacturer: ChemScene
CAS Number: 1797982-74-1
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₅H₁₆N₄O₄
Molecular Weight
316.31
Synonyms
None
SMILES
O=C1N=C(N)NC(N)=C1C(=O)CCC2=CC=C(C=C2)C(=O)OC
Tpsa
141.16
Logp
0.5364
H Acceptors
7
H Donors
3
Rotatable Bonds
5
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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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₆N₄O₄
Molecular Weight: 316.31
Synonyms: None
SMILES: O=C1N=C(N)NC(N)=C1C(=O)CCC2=CC=C(C=C2)C(=O)OC
Tpsa: 141.16
Logp: 0.5364
H Acceptors: 7
H Donors: 3
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:
C₁₅H₁₆N₄O₄
Molecular Weight:
316.31
Synonyms:
None
SMILES:
O=C1N=C(N)NC(N)=C1C(=O)CCC2=CC=C(C=C2)C(=O)OC
Tpsa:
141.16
Logp:
0.5364
H Acceptors:
7
H Donors:
3
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: C₂₄H₂₇N₅O₃
Molecular Weight: 433.50
Synonyms: None
SMILES: O=C1C2=C(N=C(N2C)N(C)CCOC(C=3C=CC=CC3)C=4C=CC=CC4)N(C(=O)N1C)C
Tpsa: 74.29
Logp: 2.2131
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₇N₅O₃
Molecular Weight:
433.50
Synonyms:
None
SMILES:
O=C1C2=C(N=C(N2C)N(C)CCOC(C=3C=CC=CC3)C=4C=CC=CC4)N(C(=O)N1C)C
Tpsa:
74.29
Logp:
2.2131
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₈ClFN₂O₂
Molecular Weight: 266.66
Synonyms: None
SMILES: O=C(NC1=CC=C(O)C=C1F)C2=NC=CC(Cl)=C2
Tpsa: 62.22
Logp: 2.832
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₈ClFN₂O₂
Molecular Weight:
266.66
Synonyms:
None
SMILES:
O=C(NC1=CC=C(O)C=C1F)C2=NC=CC(Cl)=C2
Tpsa:
62.22
Logp:
2.832
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₇NO₄S
Molecular Weight: 283.34
Synonyms: None
SMILES: O=C(N1CCOCC1)CC2=CC=C(C=C2)S(=O)(=O)C
Tpsa: 63.68
Logp: 0.4914
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₇NO₄S
Molecular Weight:
283.34
Synonyms:
None
SMILES:
O=C(N1CCOCC1)CC2=CC=C(C=C2)S(=O)(=O)C
Tpsa:
63.68
Logp:
0.4914
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3