1-(4-Methylphenyl)-1-propanol - CAS 25574-04-3
Catalog: |
BB018957 |
Product Name: |
1-(4-Methylphenyl)-1-propanol |
CAS: |
25574-04-3 |
Synonyms: |
1-(4-methylphenyl)propan-1-ol |
IUPAC Name: | 1-(4-methylphenyl)propan-1-ol |
Description: | 1-(4-Methylphenyl)-1-propanol (CAS# 25574-04-3) is used in method for synthesizing alkyne compound by catalytic asymmetric cross-coupling reaction. |
Molecular Weight: | 150.22 |
Molecular Formula: | C10H14O |
Canonical SMILES: | CCC(C1=CC=C(C=C1)C)O |
InChI: | InChI=1S/C10H14O/c1-3-10(11)9-6-4-8(2)5-7-9/h4-7,10-11H,3H2,1-2H3 |
InChI Key: | ZBDUWPZEVMGAMD-UHFFFAOYSA-N |
MDL: | MFCD00033356 |
LogP: | 2.43840 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
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Complexity: | 103 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 150.104465066 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 150.104465066 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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