CS-1002481
1,2-Propanediol, 3-(2-methylphenoxy)-, 2-carbamate
Manufacturer: ChemScene
CAS Number: 2049-31-2
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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
C₁₁H₁₅NO₄
Molecular Weight
225.24
Synonyms
None
SMILES
O=C(OC(CO)COC=1C=CC=CC1C)N
Tpsa
81.78
Logp
0.83002
H Acceptors
4
H Donors
2
Rotatable Bonds
5
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: C₁₁H₁₅NO₄
Molecular Weight: 225.24
Synonyms: None
SMILES: O=C(OC(CO)COC=1C=CC=CC1C)N
Tpsa: 81.78
Logp: 0.83002
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₅NO₄
Molecular Weight:
225.24
Synonyms:
None
SMILES:
O=C(OC(CO)COC=1C=CC=CC1C)N
Tpsa:
81.78
Logp:
0.83002
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₅NO₄S
Molecular Weight: 351.46
Synonyms: None
SMILES: C([CH-][S+](C)(C)=O)(=O)[C@@H]1[C@H](CC)CN(C(OCC2=CC=CC=C2)=O)C1
Tpsa: 63.68
Logp: 2.77119
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₅NO₄S
Molecular Weight:
351.46
Synonyms:
None
SMILES:
C([CH-][S+](C)(C)=O)(=O)[C@@H]1[C@H](CC)CN(C(OCC2=CC=CC=C2)=O)C1
Tpsa:
63.68
Logp:
2.77119
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₁H₈₁N₃O₁₃
Molecular Weight: 824.09
Synonyms: None
SMILES: O(C)[C@@]1(C)[C@@](CNCCC)(O)[C@H](C)O[C@@H](O[C@@H]([C@@H]([C@@H](O[C@H]2[C@H](O)[C@@H](N(C)C)C[C@@H](C)O2)[C@](C[C@H](CN[C@@H]([C@H]([C@]([C@@H](CC)O)(C)O)O)C)C)(C)O)C)[C@H](C(O)=O)C)C1
Tpsa: 232.13
Logp: 1.4484
H Acceptors: 15
H Donors: 9
Rotatable Bonds: 24
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₁H₈₁N₃O₁₃
Molecular Weight:
824.09
Synonyms:
None
SMILES:
O(C)[C@@]1(C)[C@@](CNCCC)(O)[C@H](C)O[C@@H](O[C@@H]([C@@H]([C@@H](O[C@H]2[C@H](O)[C@@H](N(C)C)C[C@@H](C)O2)[C@](C[C@H](CN[C@@H]([C@H]([C@]([C@@H](CC)O)(C)O)O)C)C)(C)O)C)[C@H](C(O)=O)C)C1
Tpsa:
232.13
Logp:
1.4484
H Acceptors:
15
H Donors:
9
Rotatable Bonds:
24
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₀H₇₇N₃O₁₂
Molecular Weight: 792.05
Synonyms: None
SMILES: C(NCCC)[C@@]1(O)[C@@](OC)(C)C[C@H](O[C@H]2[C@H](C)[C@@H](O[C@H]3[C@H](O)[C@@H](NC)C[C@@H](C)O3)[C@](C)(O)C[C@@H](C)CN[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]2C)O[C@H]1C
Tpsa: 209.69
Logp: 1.5861
H Acceptors: 15
H Donors: 8
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₀H₇₇N₃O₁₂
Molecular Weight:
792.05
Synonyms:
None
SMILES:
C(NCCC)[C@@]1(O)[C@@](OC)(C)C[C@H](O[C@H]2[C@H](C)[C@@H](O[C@H]3[C@H](O)[C@@H](NC)C[C@@H](C)O3)[C@](C)(O)C[C@@H](C)CN[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]2C)O[C@H]1C
Tpsa:
209.69
Logp:
1.5861
H Acceptors:
15
H Donors:
8
Rotatable Bonds:
11