CS-1004139
Vitamin D2 Impurity 4
Manufacturer: ChemScene
CAS Number: 53892-40-3
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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
C₁₁H₁₃NO₃
Molecular Weight
207.23
Synonyms
None
SMILES
O=CN(C1=CC=C(C=C1)C(=O)OCC)C
Tpsa
46.61
Logp
1.4559
H Acceptors
3
H Donors
0
Rotatable Bonds
4
Related Products
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: C₁₁H₁₃NO₃
Molecular Weight: 207.23
Synonyms: None
SMILES: O=CN(C1=CC=C(C=C1)C(=O)OCC)C
Tpsa: 46.61
Logp: 1.4559
H Acceptors: 3
H Donors: 0
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:
C₁₁H₁₃NO₃
Molecular Weight:
207.23
Synonyms:
None
SMILES:
O=CN(C1=CC=C(C=C1)C(=O)OCC)C
Tpsa:
46.61
Logp:
1.4559
H Acceptors:
3
H Donors:
0
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: C₂₀H₁₇FO₃S
Molecular Weight: 356.41
Synonyms: None
SMILES: C(=C\1/C=2C(C(CC(O)=O)=C1C)=CC(F)=CC2)\C3=CC=C(S(C)=O)C=C3
Tpsa: 54.37
Logp: 4.3655
H Acceptors: 2
H Donors: 1
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:
C₂₀H₁₇FO₃S
Molecular Weight:
356.41
Synonyms:
None
SMILES:
C(=C\1/C=2C(C(CC(O)=O)=C1C)=CC(F)=CC2)\C3=CC=C(S(C)=O)C=C3
Tpsa:
54.37
Logp:
4.3655
H Acceptors:
2
H Donors:
1
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: C₄H₇N₅S
Molecular Weight: 157.20
Synonyms: None
SMILES: N=1C(=NC(=NC1N)N)SC
Tpsa: 90.71
Logp: -0.2421
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 1
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₇N₅S
Molecular Weight:
157.20
Synonyms:
None
SMILES:
N=1C(=NC(=NC1N)N)SC
Tpsa:
90.71
Logp:
-0.2421
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: C₅₆H₇₁N₉O₂₀
Molecular Weight: 1190.21
Synonyms: None
SMILES: O=C1N2[C@@]([C@@H](O)[C@@H](C)C2)(C(=O)N[C@H](O)[C@H](O)C[C@H](NC(=O)C3=CC=C(C=C3)C=4C=C(ON4)C5=CC=C(OCCCCC)C=C5)C(=O)N[C@@]([C@@H](C)O)(C(=O)N6[C@](C(=O)N[C@@]([C@@H]([C@@H](O)C7=CC(O)=C(O)C=C7)O)(C(=O)N[C@]1([C@@H](CC(N)=O)O)[H])[H])(C[C@@H](O)C6)[H])[H])[H]
Tpsa: 466.77
Logp: -3.378
H Acceptors: 21
H Donors: 16
Rotatable Bonds: 16
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₆H₇₁N₉O₂₀
Molecular Weight:
1190.21
Synonyms:
None
SMILES:
O=C1N2[C@@]([C@@H](O)[C@@H](C)C2)(C(=O)N[C@H](O)[C@H](O)C[C@H](NC(=O)C3=CC=C(C=C3)C=4C=C(ON4)C5=CC=C(OCCCCC)C=C5)C(=O)N[C@@]([C@@H](C)O)(C(=O)N6[C@](C(=O)N[C@@]([C@@H]([C@@H](O)C7=CC(O)=C(O)C=C7)O)(C(=O)N[C@]1([C@@H](CC(N)=O)O)[H])[H])(C[C@@H](O)C6)[H])[H])[H]
Tpsa:
466.77
Logp:
-3.378
H Acceptors:
21
H Donors:
16
Rotatable Bonds:
16