CS-1000329
Hydroxyprogesterone Impurity 3
Manufacturer: ChemScene
CAS Number: 1072923-65-9
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₄H₃₄O₅
Molecular Weight
402.52
Synonyms
None
SMILES
O(C(C)=O)[C@@]1(C(C)=O)[C@]2(C)[C@@](CC1)([C@]3([C@](CC2)([C@]4(C)C([C@@H](C)C3)=CC(=O)C[C@H]4O)[H])[H])[H]
Tpsa
80.67
Logp
3.626
H Acceptors
5
H Donors
1
Rotatable Bonds
2
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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₃₄O₅
Molecular Weight: 402.52
Synonyms: None
SMILES: O(C(C)=O)[C@@]1(C(C)=O)[C@]2(C)[C@@](CC1)([C@]3([C@](CC2)([C@]4(C)C([C@@H](C)C3)=CC(=O)C[C@H]4O)[H])[H])[H]
Tpsa: 80.67
Logp: 3.626
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₃₄O₅
Molecular Weight:
402.52
Synonyms:
None
SMILES:
O(C(C)=O)[C@@]1(C(C)=O)[C@]2(C)[C@@](CC1)([C@]3([C@](CC2)([C@]4(C)C([C@@H](C)C3)=CC(=O)C[C@H]4O)[H])[H])[H]
Tpsa:
80.67
Logp:
3.626
H Acceptors:
5
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: C₆₂H₁₁₁N₁₁O₁₃
Molecular Weight: 1218.61
Synonyms: None
SMILES: [C@H]([C@@H](C/C=C/C)C)(O)[C@@]1(N(C)C(=O)[C@H]([C@H](C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H]([C@@H](C)C)NC(=O)[C@H](CC(C)(C)O)N(C)C(=O)CN(C)C(=O)[C@H](CC)NC1=O)[H]
Tpsa: 299.03
Logp: 2.3839
H Acceptors: 13
H Donors: 6
Rotatable Bonds: 15
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆₂H₁₁₁N₁₁O₁₃
Molecular Weight:
1218.61
Synonyms:
None
SMILES:
[C@H]([C@@H](C/C=C/C)C)(O)[C@@]1(N(C)C(=O)[C@H]([C@H](C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H]([C@@H](C)C)NC(=O)[C@H](CC(C)(C)O)N(C)C(=O)CN(C)C(=O)[C@H](CC)NC1=O)[H]
Tpsa:
299.03
Logp:
2.3839
H Acceptors:
13
H Donors:
6
Rotatable Bonds:
15
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₅N₃O₃
Molecular Weight: 201.22
Synonyms: None
SMILES: O=C(O)C(=O)CCCNC(=N)N(C)C
Tpsa: 93.49
Logp: -0.49373
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 5
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₅N₃O₃
Molecular Weight:
201.22
Synonyms:
None
SMILES:
O=C(O)C(=O)CCCNC(=N)N(C)C
Tpsa:
93.49
Logp:
-0.49373
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: C₁₉H₂₂FN₃O₄
Molecular Weight: 375.39
Synonyms: None
SMILES: O=C(O)C1=CN2C3=C(OCC2(C)C)C(=C(F)C=C3C1=O)N4CCN(C)CC4
Tpsa: 75.01
Logp: 1.7181
H Acceptors: 6
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:
C₁₉H₂₂FN₃O₄
Molecular Weight:
375.39
Synonyms:
None
SMILES:
O=C(O)C1=CN2C3=C(OCC2(C)C)C(=C(F)C=C3C1=O)N4CCN(C)CC4
Tpsa:
75.01
Logp:
1.7181
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
2