CS-1005061
Benzylpenicillin Impurity 1
Manufacturer: ChemScene
CAS Number: 857960-51-1
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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
C₁₆H₁₈N₂O₄S
Molecular Weight
334.39
Synonyms
None
SMILES
O=C(O)C1NC(SC1(C)C)C2N=C(OC2=O)CC=3C=CC=CC3
Tpsa
87.99
Logp
1.4473
H Acceptors
6
H Donors
2
Rotatable Bonds
4
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₈N₂O₄S
Molecular Weight: 334.39
Synonyms: None
SMILES: O=C(O)C1NC(SC1(C)C)C2N=C(OC2=O)CC=3C=CC=CC3
Tpsa: 87.99
Logp: 1.4473
H Acceptors: 6
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:
C₁₆H₁₈N₂O₄S
Molecular Weight:
334.39
Synonyms:
None
SMILES:
O=C(O)C1NC(SC1(C)C)C2N=C(OC2=O)CC=3C=CC=CC3
Tpsa:
87.99
Logp:
1.4473
H Acceptors:
6
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: C₁₀H₁₂N₂O₃
Molecular Weight: 208.21
Synonyms: None
SMILES: O=C(N)C(C1=CC=C(C=C1)N(=O)=O)CC
Tpsa: 86.23
Logp: 1.5737
H Acceptors: 3
H Donors: 1
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:
C₁₀H₁₂N₂O₃
Molecular Weight:
208.21
Synonyms:
None
SMILES:
O=C(N)C(C1=CC=C(C=C1)N(=O)=O)CC
Tpsa:
86.23
Logp:
1.5737
H Acceptors:
3
H Donors:
1
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: C₁₅H₁₆N₂O₄
Molecular Weight: 288.30
Synonyms: None
SMILES: O=C(OC)C1=C(NC(=CC1C=2C=CC=C(C2)N(=O)=O)C)C
Tpsa: 81.47
Logp: 2.6324
H Acceptors: 5
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:
C₁₅H₁₆N₂O₄
Molecular Weight:
288.30
Synonyms:
None
SMILES:
O=C(OC)C1=C(NC(=CC1C=2C=CC=C(C2)N(=O)=O)C)C
Tpsa:
81.47
Logp:
2.6324
H Acceptors:
5
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: C₁₃H₁₆O
Molecular Weight: 188.27
Synonyms: None
SMILES: O(C1=CC=2C(=CCCC2C(=C1)C)C)C
Tpsa: 9.23
Logp: 3.35312
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₆O
Molecular Weight:
188.27
Synonyms:
None
SMILES:
O(C1=CC=2C(=CCCC2C(=C1)C)C)C
Tpsa:
9.23
Logp:
3.35312
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1