CS-1001769
Letrozole Impurity 46
Manufacturer: ChemScene
CAS Number: 160388-64-7
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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
C₁₂H₁₃N₃O₂
Molecular Weight
231.25
Synonyms
None
SMILES
O=C(OCC)C1=CC=C(C=C1)CN2N=CN=C2
Tpsa
57.01
Logp
1.5031
H Acceptors
5
H Donors
0
Rotatable Bonds
4
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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: C₁₂H₁₃N₃O₂
Molecular Weight: 231.25
Synonyms: None
SMILES: O=C(OCC)C1=CC=C(C=C1)CN2N=CN=C2
Tpsa: 57.01
Logp: 1.5031
H Acceptors: 5
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:
C₁₂H₁₃N₃O₂
Molecular Weight:
231.25
Synonyms:
None
SMILES:
O=C(OCC)C1=CC=C(C=C1)CN2N=CN=C2
Tpsa:
57.01
Logp:
1.5031
H Acceptors:
5
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: C₂₈H₂₆N₄O₅
Molecular Weight: 498.53
Synonyms: None
SMILES: O=C1ON=C(N1)C=2C=CC=CC2C=3C=CC(=CC3)CN4C(=NC=5C=CC=C(C(=O)OC(C)C)C54)OCC
Tpsa: 112.24
Logp: 5.0588
H Acceptors: 8
H Donors: 1
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₂₆N₄O₅
Molecular Weight:
498.53
Synonyms:
None
SMILES:
O=C1ON=C(N1)C=2C=CC=CC2C=3C=CC(=CC3)CN4C(=NC=5C=CC=C(C(=O)OC(C)C)C54)OCC
Tpsa:
112.24
Logp:
5.0588
H Acceptors:
8
H Donors:
1
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂H₅NO₄
Molecular Weight: 107.07
Synonyms: None
SMILES: O=N(=O)OCCO
Tpsa: 72.6
Logp: -0.813
H Acceptors: 4
H Donors: 1
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:
C₂H₅NO₄
Molecular Weight:
107.07
Synonyms:
None
SMILES:
O=N(=O)OCCO
Tpsa:
72.6
Logp:
-0.813
H Acceptors:
4
H Donors:
1
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: C₁₅H₁₉NO₂
Molecular Weight: 245.32
Synonyms: None
SMILES: O=C(OC1CC2N(C)C(CC2)C1)C=3C=CC=CC3
Tpsa: 29.54
Logp: 2.4686
H Acceptors: 3
H Donors: 0
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:
C₁₅H₁₉NO₂
Molecular Weight:
245.32
Synonyms:
None
SMILES:
O=C(OC1CC2N(C)C(CC2)C1)C=3C=CC=CC3
Tpsa:
29.54
Logp:
2.4686
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2