CS-0854537
3-Hydroxy Cyclobenzaprine(E / Z Mixture)
Manufacturer: ChemScene
CAS Number: 30235-48-4
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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
C₂₀H₂₁NO
Molecular Weight
291.39
Synonyms
None
SMILES
CN(C)CC/C=C1C(C=C(O)C=C2)=C2C=CC3=CC=CC=C3\1
Tpsa
23.47
Logp
4.2594
H Acceptors
2
H Donors
1
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 30235-48-4 | 5H-Dibenzo[a,d]cyclohepten-3-ol,5-[3-(dimethylamino)propylidene]- | A2B Chem | -- |
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SAFETY INFORMATION
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: C₂₀H₂₁NO
Molecular Weight: 291.39
Synonyms: None
SMILES: CN(C)CC/C=C1C(C=C(O)C=C2)=C2C=CC3=CC=CC=C3\1
Tpsa: 23.47
Logp: 4.2594
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₁NO
Molecular Weight:
291.39
Synonyms:
None
SMILES:
CN(C)CC/C=C1C(C=C(O)C=C2)=C2C=CC3=CC=CC=C3\1
Tpsa:
23.47
Logp:
4.2594
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₂₄ClN₅OS₂
Molecular Weight: 546.11
Synonyms: None
SMILES: C1CN(CCN1CCC2=C(C=C3C(=C2)C(C(=O)N3)C4=NSC5=CC=CC=C54)Cl)C6=NSC7=CC=CC=C76
Tpsa: 61.36
Logp: 6.0081
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 5
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₂₄ClN₅OS₂
Molecular Weight:
546.11
Synonyms:
None
SMILES:
C1CN(CCN1CCC2=C(C=C3C(=C2)C(C(=O)N3)C4=NSC5=CC=CC=C54)Cl)C6=NSC7=CC=CC=C76
Tpsa:
61.36
Logp:
6.0081
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
5
Purity: ≥95%
MDL No: MFCD06796945
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₂H₄₉NO₉
Molecular Weight: 591.73
Synonyms: None
SMILES: CCCCCCCCCCCCCCCC(=O)NC1=C(C=C2C(=C1)C(=CC(=O)O2)C)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O
Tpsa: 158.69
Logp: 4.69992
H Acceptors: 9
H Donors: 5
Rotatable Bonds: 18
Purity:
≥95%
MDL No:
MFCD06796945
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₂H₄₉NO₉
Molecular Weight:
591.73
Synonyms:
None
SMILES:
CCCCCCCCCCCCCCCC(=O)NC1=C(C=C2C(=C1)C(=CC(=O)O2)C)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O
Tpsa:
158.69
Logp:
4.69992
H Acceptors:
9
H Donors:
5
Rotatable Bonds:
18
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₃₀O₆
Molecular Weight: 414.49
Synonyms: None
SMILES: O=C1C=C[C@]2(C)[C@@]3([C@@]4([H])CCC2=C1)[C@@H](O3)C[C@@]5(C)[C@@]4([H])C[C@H](C)[C@]5(O)C(COC(C)=O)=O
Tpsa: 93.2
Logp: 2.5349
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₃₀O₆
Molecular Weight:
414.49
Synonyms:
None
SMILES:
O=C1C=C[C@]2(C)[C@@]3([C@@]4([H])CCC2=C1)[C@@H](O3)C[C@@]5(C)[C@@]4([H])C[C@H](C)[C@]5(O)C(COC(C)=O)=O
Tpsa:
93.2
Logp:
2.5349
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
3