CS-1000337
N-[(4-Methylphenyl)sulfonyl]carbamic acid
Manufacturer: ChemScene
CAS Number: 107628-27-3
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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
C₈H₉NO₄S
Molecular Weight
215.23
Synonyms
None
SMILES
O=C(O)NS(=O)(=O)C1=CC=C(C=C1)C
Tpsa
83.47
Logp
0.95132
H Acceptors
3
H Donors
2
Rotatable Bonds
2
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: C₈H₉NO₄S
Molecular Weight: 215.23
Synonyms: None
SMILES: O=C(O)NS(=O)(=O)C1=CC=C(C=C1)C
Tpsa: 83.47
Logp: 0.95132
H Acceptors: 3
H Donors: 2
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:
C₈H₉NO₄S
Molecular Weight:
215.23
Synonyms:
None
SMILES:
O=C(O)NS(=O)(=O)C1=CC=C(C=C1)C
Tpsa:
83.47
Logp:
0.95132
H Acceptors:
3
H Donors:
2
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: C₅₈H₈₀ClN₂O₁₄+
Molecular Weight: 1064.71
Synonyms: None
SMILES: C([C@@H]1C=2C(=CC(OC)=C(OC)C2)CC[N@@+]1(CCCOC(CC/C=C/CCC(OCCC[N@@+]3(C)[C@H](CC4=CC(OC)=C(OC)C(OC)=C4)C=5C(CC3)=CC(OC)=C(OC)C5)=O)=O)C)C6=CC(OC)=C(OC)C(OC)=C6.[Cl-]
Tpsa: 144.9
Logp: 6.033
H Acceptors: 14
H Donors: 0
Rotatable Bonds: 28
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₈H₈₀ClN₂O₁₄+
Molecular Weight:
1064.71
Synonyms:
None
SMILES:
C([C@@H]1C=2C(=CC(OC)=C(OC)C2)CC[N@@+]1(CCCOC(CC/C=C/CCC(OCCC[N@@+]3(C)[C@H](CC4=CC(OC)=C(OC)C(OC)=C4)C=5C(CC3)=CC(OC)=C(OC)C5)=O)=O)C)C6=CC(OC)=C(OC)C(OC)=C6.[Cl-]
Tpsa:
144.9
Logp:
6.033
H Acceptors:
14
H Donors:
0
Rotatable Bonds:
28
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₃₆ClNO₆
Molecular Weight: 482.01
Synonyms: None
SMILES: C([C@@H]1C=2C(=CC(OC)=C(OC)C2)CC[N@@+]1(CCCO)C)C3=CC(OC)=C(OC)C(OC)=C3.[Cl-]
Tpsa: 66.38
Logp: 0.4025
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₆ClNO₆
Molecular Weight:
482.01
Synonyms:
None
SMILES:
C([C@@H]1C=2C(=CC(OC)=C(OC)C2)CC[N@@+]1(CCCO)C)C3=CC(OC)=C(OC)C(OC)=C3.[Cl-]
Tpsa:
66.38
Logp:
0.4025
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅₈H₈₀ClN₂O₁₄+
Molecular Weight: 1064.71
Synonyms: None
SMILES: C([C@@H]1C=2C(=CC(OC)=C(OC)C2)CC[N@@+]1(CCCOC(CC/C=C/CCC(OCCC[N@+]3(C)[C@H](CC4=CC(OC)=C(OC)C(OC)=C4)C=5C(CC3)=CC(OC)=C(OC)C5)=O)=O)C)C6=CC(OC)=C(OC)C(OC)=C6.[Cl-]
Tpsa: 144.9
Logp: 6.033
H Acceptors: 14
H Donors: 0
Rotatable Bonds: 28
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₈H₈₀ClN₂O₁₄+
Molecular Weight:
1064.71
Synonyms:
None
SMILES:
C([C@@H]1C=2C(=CC(OC)=C(OC)C2)CC[N@@+]1(CCCOC(CC/C=C/CCC(OCCC[N@+]3(C)[C@H](CC4=CC(OC)=C(OC)C(OC)=C4)C=5C(CC3)=CC(OC)=C(OC)C5)=O)=O)C)C6=CC(OC)=C(OC)C(OC)=C6.[Cl-]
Tpsa:
144.9
Logp:
6.033
H Acceptors:
14
H Donors:
0
Rotatable Bonds:
28