CS-0881988
4-(Methoxycarbonyl)-3,5-dimethylbenzoic acid
Manufacturer: ChemScene
CAS Number: 18958-19-5
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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
C₁₁H₁₂O₄
Molecular Weight
208.21
Synonyms
None
SMILES
O=C(C1=C(C)C=C(C(O)=O)C=C1C)OC
Tpsa
63.6
Logp
1.78824
H Acceptors
3
H Donors
1
Rotatable Bonds
2
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: C₁₁H₁₂O₄
Molecular Weight: 208.21
Synonyms: None
SMILES: O=C(C1=C(C)C=C(C(O)=O)C=C1C)OC
Tpsa: 63.6
Logp: 1.78824
H Acceptors: 3
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:
C₁₁H₁₂O₄
Molecular Weight:
208.21
Synonyms:
None
SMILES:
O=C(C1=C(C)C=C(C(O)=O)C=C1C)OC
Tpsa:
63.6
Logp:
1.78824
H Acceptors:
3
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: C₁₇H₂₂ClNO₂
Molecular Weight: 307.82
Synonyms: None
SMILES: O=C(N1CCCC2(CC2)C3=CC(Cl)=CC=C31)OC(C)(C)C
Tpsa: 29.54
Logp: 4.9069
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₂ClNO₂
Molecular Weight:
307.82
Synonyms:
None
SMILES:
O=C(N1CCCC2(CC2)C3=CC(Cl)=CC=C31)OC(C)(C)C
Tpsa:
29.54
Logp:
4.9069
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂ClF₂NO
Molecular Weight: 259.68
Synonyms: None
SMILES: FC1(CCNC2=CC=C(C=C2C13OCC3)Cl)F
Tpsa: 21.26
Logp: 3.4065
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂ClF₂NO
Molecular Weight:
259.68
Synonyms:
None
SMILES:
FC1(CCNC2=CC=C(C=C2C13OCC3)Cl)F
Tpsa:
21.26
Logp:
3.4065
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₇NO₄S
Molecular Weight: 201.20
Synonyms: None
SMILES: O=C(C1=NC(C)=C(C(OC)=O)S1)O
Tpsa: 76.49
Logp: 0.93632
H Acceptors: 5
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:
C₇H₇NO₄S
Molecular Weight:
201.20
Synonyms:
None
SMILES:
O=C(C1=NC(C)=C(C(OC)=O)S1)O
Tpsa:
76.49
Logp:
0.93632
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2