CS-0379808
(1R,4R)-4-(3,4-Dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine hydrochloride Sertraline Impurity
Manufacturer: ChemScene
CAS Number: 79645-15-1
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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
C₁₇H₁₈Cl₃N
Molecular Weight
342.69
Synonyms
Sertraline hydrochloride, cis-(-)-
SMILES
CN[C@H]1C2=CC=CC=C2[C@@H](C3=CC(Cl)=C(C=C3)Cl)CC1.Cl
Tpsa
12.03
Logp
5.6014
H Acceptors
1
H Donors
1
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | (R,R)-Sertraline hydrochloride | ChemScene | -- | |
 | 79645-15-1 | Sertraline Hcl | A2B Chem | ₹ 25,496.88 - ₹ 1,32,361.32 |
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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: C₁₇H₁₈Cl₃N
Molecular Weight: 342.69
Synonyms: Sertraline hydrochloride, cis-(-)-
SMILES: CN[C@H]1C2=CC=CC=C2[C@@H](C3=CC(Cl)=C(C=C3)Cl)CC1.Cl
Tpsa: 12.03
Logp: 5.6014
H Acceptors: 1
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:
C₁₇H₁₈Cl₃N
Molecular Weight:
342.69
Synonyms:
Sertraline hydrochloride, cis-(-)-
SMILES:
CN[C@H]1C2=CC=CC=C2[C@@H](C3=CC(Cl)=C(C=C3)Cl)CC1.Cl
Tpsa:
12.03
Logp:
5.6014
H Acceptors:
1
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: C₁₂H₁₆N₂O₄
Molecular Weight: 252.27
Synonyms: Diethyl 1,4-phenylenebiscarbamate
SMILES: O=C(NC1=CC=C(NC(OCC)=O)C=C1)OCC
Tpsa: 76.66
Logp: 2.8234
H Acceptors: 4
H Donors: 2
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:
C₁₂H₁₆N₂O₄
Molecular Weight:
252.27
Synonyms:
Diethyl 1,4-phenylenebiscarbamate
SMILES:
O=C(NC1=CC=C(NC(OCC)=O)C=C1)OCC
Tpsa:
76.66
Logp:
2.8234
H Acceptors:
4
H Donors:
2
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: C₁₇H₁₇N₃O₈S
Molecular Weight: 423.40
Synonyms: (6R,7R)-3-(acetyloxymethyl)-7-[[(2E)-2-(furan-2-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES: OC(C1=C(COC(C)=O)CS[C@@]([C@@H]2NC(/C(C3=CC=CO3)=N/OC)=O)([H])N1C2=O)=O
Tpsa: 147.74
Logp: -0.0682
H Acceptors: 9
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₇N₃O₈S
Molecular Weight:
423.40
Synonyms:
(6R,7R)-3-(acetyloxymethyl)-7-[[(2E)-2-(furan-2-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES:
OC(C1=C(COC(C)=O)CS[C@@]([C@@H]2NC(/C(C3=CC=CO3)=N/OC)=O)([H])N1C2=O)=O
Tpsa:
147.74
Logp:
-0.0682
H Acceptors:
9
H Donors:
2
Rotatable Bonds:
7
Purity: 98%
MDL No: MFCD29060004
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₈H₆₇NO₁₂
Molecular Weight: 729.94
Synonyms: Oxacyclotetradecane Erythromycin Derivative
SMILES: CO[C@](C)(C[C@H](C(/C(C)=C/[C@](O)([C@H](OC([C@@H]([C@H]([C@@H]1C)O[C@H]2C[C@](C)([C@H]([C@@H](O2)C)O)OC)C)=O)CC)C)=O)C)[C@@H]1O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O
Tpsa: 162.68
Logp: 3.389
H Acceptors: 13
H Donors: 3
Rotatable Bonds: 8
Purity:
98%
MDL No:
MFCD29060004
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₈H₆₇NO₁₂
Molecular Weight:
729.94
Synonyms:
Oxacyclotetradecane Erythromycin Derivative
SMILES:
CO[C@](C)(C[C@H](C(/C(C)=C/[C@](O)([C@H](OC([C@@H]([C@H]([C@@H]1C)O[C@H]2C[C@](C)([C@H]([C@@H](O2)C)O)OC)C)=O)CC)C)=O)C)[C@@H]1O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O
Tpsa:
162.68
Logp:
3.389
H Acceptors:
13
H Donors:
3
Rotatable Bonds:
8