CS-0377206
(S,E)-4-Methyl-5-((E)-2-((1R,3aS,7aR)-7a-methyl-1-((R)-6-methylheptan-2-yl)hexahydro-1H-inden-4(2H)-ylidene)ethylidene)cyclohex-3-enol Vitamin D3 Impurity
Manufacturer: ChemScene
CAS Number: 42607-12-5
The price for this product is unavailable. Please request a quote
Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₇H₄₄O
Molecular Weight
384.64
Synonyms
Isovitamin D3 ()
SMILES
O[C@H]1CC=C(C)/C(C1)=C/C=C2[C@]3([H])CC[C@H]([C@H](C)CCCC(C)C)[C@@]3(C)CCC/2
Tpsa
20.23
Logp
7.619
H Acceptors
1
H Donors
1
Rotatable Bonds
6
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
Compare Similar Items
Show Difference
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₄₄O
Molecular Weight: 384.64
Synonyms: Isovitamin D3 ()
SMILES: O[C@H]1CC=C(C)/C(C1)=C/C=C2[C@]3([H])CC[C@H]([C@H](C)CCCC(C)C)[C@@]3(C)CCC/2
Tpsa: 20.23
Logp: 7.619
H Acceptors: 1
H Donors: 1
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:
C₂₇H₄₄O
Molecular Weight:
384.64
Synonyms:
Isovitamin D3 ()
SMILES:
O[C@H]1CC=C(C)/C(C1)=C/C=C2[C@]3([H])CC[C@H]([C@H](C)CCCC(C)C)[C@@]3(C)CCC/2
Tpsa:
20.23
Logp:
7.619
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₆N₂O₄
Molecular Weight: 300.31
Synonyms: None
SMILES: O=C(C)NC1=CC=C(C=C1)OC2=CC=C(NC(C)=O)C=C2O
Tpsa: 87.66
Logp: 3.1013
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₆N₂O₄
Molecular Weight:
300.31
Synonyms:
None
SMILES:
O=C(C)NC1=CC=C(C=C1)OC2=CC=C(NC(C)=O)C=C2O
Tpsa:
87.66
Logp:
3.1013
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD01727458
Storage: 4°C, stored under nitrogen, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂ClNO₂
Molecular Weight: 201.65
Synonyms: Phenylephrone Hydrochloride
SMILES: O=C(CNC)C1=CC(O)=CC=C1.Cl
Tpsa: 49.33
Logp: 1.2161
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD01727458
Storage:
4°C, stored under nitrogen, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂ClNO₂
Molecular Weight:
201.65
Synonyms:
Phenylephrone Hydrochloride
SMILES:
O=C(CNC)C1=CC(O)=CC=C1.Cl
Tpsa:
49.33
Logp:
1.2161
H Acceptors:
3
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: C₁₆H₁₉NO₂
Molecular Weight: 257.33
Synonyms: Phenylephrine Related Compound D ((R)-3-{2-[Benzyl(methyl)amino]-1-hydroxyethyl}phenol)
SMILES: CN(CC1=CC=CC=C1)C[C@@H](C2=CC(O)=CC=C2)O
Tpsa: 43.7
Logp: 2.5576
H Acceptors: 3
H Donors: 2
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:
C₁₆H₁₉NO₂
Molecular Weight:
257.33
Synonyms:
Phenylephrine Related Compound D ((R)-3-{2-[Benzyl(methyl)amino]-1-hydroxyethyl}phenol)
SMILES:
CN(CC1=CC=CC=C1)C[C@@H](C2=CC(O)=CC=C2)O
Tpsa:
43.7
Logp:
2.5576
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
5