CS-1003479
Fosaprepitant Impurity 42
Manufacturer: ChemScene
CAS Number: 29355-05-3
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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
C₇H₁₅NO₅
Molecular Weight
193.20
Synonyms
None
SMILES
C(O)[C@H]1OC(NC)[C@H](O)[C@@H](O)[C@@H]1O
Tpsa
102.18
Logp
-2.9943
H Acceptors
6
H Donors
5
Rotatable Bonds
2
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: C₇H₁₅NO₅
Molecular Weight: 193.20
Synonyms: None
SMILES: C(O)[C@H]1OC(NC)[C@H](O)[C@@H](O)[C@@H]1O
Tpsa: 102.18
Logp: -2.9943
H Acceptors: 6
H Donors: 5
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:
C₇H₁₅NO₅
Molecular Weight:
193.20
Synonyms:
None
SMILES:
C(O)[C@H]1OC(NC)[C@H](O)[C@@H](O)[C@@H]1O
Tpsa:
102.18
Logp:
-2.9943
H Acceptors:
6
H Donors:
5
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: C₂₀H₂₃NO₅
Molecular Weight: 357.40
Synonyms: None
SMILES: O[C@]12[C@@]34C=5C(O[C@]3(C(=O)CC1)[H])=C(OC)C=CC5[C@H](O)[C@]2(N(CC=C)CC4)[H]
Tpsa: 79.23
Logp: 1.0953
H Acceptors: 6
H Donors: 2
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:
C₂₀H₂₃NO₅
Molecular Weight:
357.40
Synonyms:
None
SMILES:
O[C@]12[C@@]34C=5C(O[C@]3(C(=O)CC1)[H])=C(OC)C=CC5[C@H](O)[C@]2(N(CC=C)CC4)[H]
Tpsa:
79.23
Logp:
1.0953
H Acceptors:
6
H Donors:
2
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: C₉H₁₂F₂N₂O₆
Molecular Weight: 282.20
Synonyms: None
SMILES: FC1(F)[C@@H](O[C@H](CO)[C@H]1O)N2[C@H](O)CC(=O)NC2=O
Tpsa: 119.33
Logp: -2.0399
H Acceptors: 6
H Donors: 4
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:
C₉H₁₂F₂N₂O₆
Molecular Weight:
282.20
Synonyms:
None
SMILES:
FC1(F)[C@@H](O[C@H](CO)[C@H]1O)N2[C@H](O)CC(=O)NC2=O
Tpsa:
119.33
Logp:
-2.0399
H Acceptors:
6
H Donors:
4
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: C₁₁H₁₄O₂
Molecular Weight: 178.23
Synonyms: None
SMILES: O=C(OC)CCC=1C=CC=C(C1)C
Tpsa: 26.3
Logp: 2.10062
H Acceptors: 2
H Donors: 0
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:
C₁₁H₁₄O₂
Molecular Weight:
178.23
Synonyms:
None
SMILES:
O=C(OC)CCC=1C=CC=C(C1)C
Tpsa:
26.3
Logp:
2.10062
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3