CS-1003416
Methotrexate Impurity 55
Manufacturer: ChemScene
CAS Number: 2801801-56-7
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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
C₇H₇BrN₆
Molecular Weight
255.07
Synonyms
None
SMILES
BrCC=1N=C2N=C(N=C(N)C2=NC1)N
Tpsa
103.6
Logp
0.4791
H Acceptors
6
H Donors
2
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 2801801-56-7 | | A2B Chem | -- |
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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: C₇H₇BrN₆
Molecular Weight: 255.07
Synonyms: None
SMILES: BrCC=1N=C2N=C(N=C(N)C2=NC1)N
Tpsa: 103.6
Logp: 0.4791
H Acceptors: 6
H Donors: 2
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:
C₇H₇BrN₆
Molecular Weight:
255.07
Synonyms:
None
SMILES:
BrCC=1N=C2N=C(N=C(N)C2=NC1)N
Tpsa:
103.6
Logp:
0.4791
H Acceptors:
6
H Donors:
2
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: C₂₁H₂₉BrO₃
Molecular Weight: 409.36
Synonyms: None
SMILES: C[C@@]12[C@]([C@]3([C@](CC1)([C@]4(C)C(CC3)=CC(=O)CC4)[H])[H])(C[C@H](Br)[C@@]2(C(C)=O)O)[H]
Tpsa: 54.37
Logp: 4.2118
H Acceptors: 3
H Donors: 1
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:
C₂₁H₂₉BrO₃
Molecular Weight:
409.36
Synonyms:
None
SMILES:
C[C@@]12[C@]([C@]3([C@](CC1)([C@]4(C)C(CC3)=CC(=O)CC4)[H])[H])(C[C@H](Br)[C@@]2(C(C)=O)O)[H]
Tpsa:
54.37
Logp:
4.2118
H Acceptors:
3
H Donors:
1
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: C₁₄H₉NO₃
Molecular Weight: 239.23
Synonyms: None
SMILES: N#CC1=CC=C(OC2=CC=C(O)C(C=O)=C2)C=C1
Tpsa: 70.32
Logp: 2.86868
H Acceptors: 4
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:
C₁₄H₉NO₃
Molecular Weight:
239.23
Synonyms:
None
SMILES:
N#CC1=CC=C(OC2=CC=C(O)C(C=O)=C2)C=C1
Tpsa:
70.32
Logp:
2.86868
H Acceptors:
4
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: C₁₂H₁₆BCl₂NO₃
Molecular Weight: 303.98
Synonyms: None
SMILES: C(N[C@@H](CC(C)C)B(O)O)(=O)C1=C(Cl)C=CC(Cl)=C1
Tpsa: 69.56
Logp: 2.1499
H Acceptors: 3
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:
C₁₂H₁₆BCl₂NO₃
Molecular Weight:
303.98
Synonyms:
None
SMILES:
C(N[C@@H](CC(C)C)B(O)O)(=O)C1=C(Cl)C=CC(Cl)=C1
Tpsa:
69.56
Logp:
2.1499
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
5