CS-1005278
Pemetrexed Impurity 55
Manufacturer: ChemScene
CAS Number: 912935-56-9
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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
C₁₂H₁₄O₃
Molecular Weight
206.24
Synonyms
None
SMILES
C(OC)(=O)C1=CC=C(/C=C/CCO)C=C1
Tpsa
46.53
Logp
1.8688
H Acceptors
3
H Donors
1
Rotatable Bonds
4
SAFETY INFORMATION
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: C₁₂H₁₄O₃
Molecular Weight: 206.24
Synonyms: None
SMILES: C(OC)(=O)C1=CC=C(/C=C/CCO)C=C1
Tpsa: 46.53
Logp: 1.8688
H Acceptors: 3
H Donors: 1
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:
C₁₂H₁₄O₃
Molecular Weight:
206.24
Synonyms:
None
SMILES:
C(OC)(=O)C1=CC=C(/C=C/CCO)C=C1
Tpsa:
46.53
Logp:
1.8688
H Acceptors:
3
H Donors:
1
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: C₁₄H₁₃ClO
Molecular Weight: 232.71
Synonyms: None
SMILES: [C@@](C)(O)(C1=CC=C(Cl)C=C1)C2=CC=CC=C2
Tpsa: 20.23
Logp: 3.5958
H Acceptors: 1
H Donors: 1
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:
C₁₄H₁₃ClO
Molecular Weight:
232.71
Synonyms:
None
SMILES:
[C@@](C)(O)(C1=CC=C(Cl)C=C1)C2=CC=CC=C2
Tpsa:
20.23
Logp:
3.5958
H Acceptors:
1
H Donors:
1
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: C₆H₁₂ClNO
Molecular Weight: 149.62
Synonyms: None
SMILES: ClC(=NO)C(CC)CC
Tpsa: 32.59
Logp: 2.4491
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₂ClNO
Molecular Weight:
149.62
Synonyms:
None
SMILES:
ClC(=NO)C(CC)CC
Tpsa:
32.59
Logp:
2.4491
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₇NO
Molecular Weight: 287.36
Synonyms: None
SMILES: O=CNC(C=1C=CC=CC1)C=2C=CC(=CC2)C=3C=CC=CC3
Tpsa: 29.1
Logp: 4.189
H Acceptors: 1
H Donors: 1
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:
C₂₀H₁₇NO
Molecular Weight:
287.36
Synonyms:
None
SMILES:
O=CNC(C=1C=CC=CC1)C=2C=CC(=CC2)C=3C=CC=CC3
Tpsa:
29.1
Logp:
4.189
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
5