CS-0531523
(8S,9R,10R,11S,13S,14R,16S,17R)-8-Fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one Betamethasone Impurity
Manufacturer: ChemScene
CAS Number: 185613-69-8
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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
C₂₂H₂₉FO₅
Molecular Weight
392.46
Synonyms
8-Fluoro-11beta,17,21-trihydroxy-16beta-methyl-8alpha,9beta-pregna-1,4-diene-3,20-dione
SMILES
F[C@@]12[C@@]3([H])[C@@]([C@](O)([C@H](C3)C)C(CO)=O)(C[C@@H]([C@@]1([H])[C@@]4(C(CC2)=CC(C=C4)=O)C)O)C
Tpsa
94.83
Logp
1.8957
H Acceptors
5
H Donors
3
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: C₂₂H₂₉FO₅
Molecular Weight: 392.46
Synonyms: 8-Fluoro-11beta,17,21-trihydroxy-16beta-methyl-8alpha,9beta-pregna-1,4-diene-3,20-dione
SMILES: F[C@@]12[C@@]3([H])[C@@]([C@](O)([C@H](C3)C)C(CO)=O)(C[C@@H]([C@@]1([H])[C@@]4(C(CC2)=CC(C=C4)=O)C)O)C
Tpsa: 94.83
Logp: 1.8957
H Acceptors: 5
H Donors: 3
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:
C₂₂H₂₉FO₅
Molecular Weight:
392.46
Synonyms:
8-Fluoro-11beta,17,21-trihydroxy-16beta-methyl-8alpha,9beta-pregna-1,4-diene-3,20-dione
SMILES:
F[C@@]12[C@@]3([H])[C@@]([C@](O)([C@H](C3)C)C(CO)=O)(C[C@@H]([C@@]1([H])[C@@]4(C(CC2)=CC(C=C4)=O)C)O)C
Tpsa:
94.83
Logp:
1.8957
H Acceptors:
5
H Donors:
3
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: C₁₅H₂₂Cl₃N₃
Molecular Weight: 350.71
Synonyms: None
SMILES: CN(CCC1=NC=CC=C1)CCC2=NC=CC=C2.Cl.Cl.Cl
Tpsa: 29.02
Logp: 3.459
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₂Cl₃N₃
Molecular Weight:
350.71
Synonyms:
None
SMILES:
CN(CCC1=NC=CC=C1)CCC2=NC=CC=C2.Cl.Cl.Cl
Tpsa:
29.02
Logp:
3.459
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₉Cl₂NO₂
Molecular Weight: 304.21
Synonyms: Ortho-chlorambucil
SMILES: O=C(CCCC1=C(N(CCCl)CCCl)C=CC=C1)O
Tpsa: 40.54
Logp: 3.3779
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₉Cl₂NO₂
Molecular Weight:
304.21
Synonyms:
Ortho-chlorambucil
SMILES:
O=C(CCCC1=C(N(CCCl)CCCl)C=CC=C1)O
Tpsa:
40.54
Logp:
3.3779
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
9
Purity: 97%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₄BrF₂O₃P
Molecular Weight: 343.10
Synonyms: Phosphonic acid, P-[(4-bromophenyl)difluoromethyl]-, diethyl ester
SMILES: O=P(OCC)(C(F)(C1=CC=C(C=C1)Br)F)OCC
Tpsa: 35.53
Logp: 4.7645
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 6
Purity:
97%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₄BrF₂O₃P
Molecular Weight:
343.10
Synonyms:
Phosphonic acid, P-[(4-bromophenyl)difluoromethyl]-, diethyl ester
SMILES:
O=P(OCC)(C(F)(C1=CC=C(C=C1)Br)F)OCC
Tpsa:
35.53
Logp:
4.7645
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
6