CS-0913964
methyl (Z)-2-(11-(3-(dimethylamino)propylidene)-6,11-dihydrodibenzo[b,e]oxepin-2-yl)acetate
Manufacturer: ChemScene
CAS Number: 113806-01-2
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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
C₂₂H₂₅NO₃
Molecular Weight
351.44
Synonyms
None
SMILES
C(\CCN(C)C)=C/1\C=2C(OCC=3C1=CC=CC3)=CC=C(CC(OC)=O)C2
Tpsa
38.77
Logp
3.6779
H Acceptors
4
H Donors
0
Rotatable Bonds
5
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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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₅NO₃
Molecular Weight: 351.44
Synonyms: None
SMILES: C(\CCN(C)C)=C/1\C=2C(OCC=3C1=CC=CC3)=CC=C(CC(OC)=O)C2
Tpsa: 38.77
Logp: 3.6779
H Acceptors: 4
H Donors: 0
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:
C₂₂H₂₅NO₃
Molecular Weight:
351.44
Synonyms:
None
SMILES:
C(\CCN(C)C)=C/1\C=2C(OCC=3C1=CC=CC3)=CC=C(CC(OC)=O)C2
Tpsa:
38.77
Logp:
3.6779
H Acceptors:
4
H Donors:
0
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: C₂₀H₂₁NO₂
Molecular Weight: 307.39
Synonyms: None
SMILES: O=CC1=CC=C2OCC=3C=CC=CC3C(=CCCN(C)C)C2=C1
Tpsa: 29.54
Logp: 3.7749
H Acceptors: 3
H Donors: 0
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:
C₂₀H₂₁NO₂
Molecular Weight:
307.39
Synonyms:
None
SMILES:
O=CC1=CC=C2OCC=3C=CC=CC3C(=CCCN(C)C)C2=C1
Tpsa:
29.54
Logp:
3.7749
H Acceptors:
3
H Donors:
0
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: C₂₃H₂₇NO₃
Molecular Weight: 365.47
Synonyms: None
SMILES: C(\CCN(C)C)=C/1\C=2C(OCC=3C1=CC=CC3)=CC=C(CC(OCC)=O)C2
Tpsa: 38.77
Logp: 4.068
H Acceptors: 4
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:
C₂₃H₂₇NO₃
Molecular Weight:
365.47
Synonyms:
None
SMILES:
C(\CCN(C)C)=C/1\C=2C(OCC=3C1=CC=CC3)=CC=C(CC(OCC)=O)C2
Tpsa:
38.77
Logp:
4.068
H Acceptors:
4
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: C₂₉H₅₃NO₅
Molecular Weight: 495.73
Synonyms: None
SMILES: C([C@H](OC([C@H](CC(C)C)NC=O)=O)CCCCCCCCCCC)[C@@H]1[C@H](CCCCCC)C(=O)O1
Tpsa: 81.7
Logp: 6.8819
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 23
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₉H₅₃NO₅
Molecular Weight:
495.73
Synonyms:
None
SMILES:
C([C@H](OC([C@H](CC(C)C)NC=O)=O)CCCCCCCCCCC)[C@@H]1[C@H](CCCCCC)C(=O)O1
Tpsa:
81.7
Logp:
6.8819
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
23