1-Phenyl-1-propanol - CAS 93-54-9

Catalog:	BB040964
Product Name:	1-Phenyl-1-propanol
CAS:	93-54-9
Synonyms:	1-phenylpropan-1-ol

Technical Data

Safety and Hazards

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Computed Properties

IUPAC Name:	1-phenylpropan-1-ol
Description:	1-Phenyl-1-propanol (CAS# 93-54-9) is a useful research chemical.
Molecular Weight:	136.19
Molecular Formula:	C9H12O
Canonical SMILES:	CCC(C1=CC=CC=C1)O
InChI:	InChI=1S/C9H12O/c1-2-9(10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3
InChI Key:	DYUQAZSOFZSPHD-UHFFFAOYSA-N
Boiling Point:	219 °C
Density:	0.994 g/cm³
Solubility:	0.6 g/L at 20 °C (exp)
Appearance:	Clear colorless liquid
Storage:	Sealed in dry, Room Temperature
MDL:	MFCD00004564
LogP:	2.13000

Publication Number	Title	Priority Date
CN-113461563-A	NQO1 activated 6-diazo-5-oxo-L-norleucine prodrug and preparation method and application thereof	20210727
CN-113354556-A	C3Chiral ligand H3L with symmetry amide bond, preparation method and application	20210705
CN-113354559-A	2- (2-benzoyl-5-oxo-3, 5-diphenyl amyl) malononitrile derivative and preparation method thereof	20210630
CN-113511990-A	N-protected (E) -2- (aminomethyl) -1, 3-diphenylprop-2-en-1-one derivatives and preparation thereof	20210630
CN-113354718-A	Piranin precursor, expression cassette and preparation method thereof	20210621

PMID	Publication Date	Title	Journal
25830490	20161025	(Electro)Sensing of Phenicol Antibiotics-A Review	Critical reviews in food science and nutrition
25623169	20151001	In vitro assessment of chloramphenicol and florfenicol as second-line antimicrobial agents in dogs	Journal of veterinary pharmacology and therapeutics
25567063	20150601	Degradation of florfenicol in water by UV/Na2S 2O 8 process	Environmental science and pollution research international
22960224	20121101	Impacts of florfenicol on marine diatom Skeletonema costatum through photosynthesis inhibition and oxidative damages	Plant physiology and biochemistry : PPB
22509728	20120801	Novel and uncommon antimicrobial resistance genes in livestock-associated methicillin-resistant Staphylococcus aureus	Clinical microbiology and infection : the official publication of the European Society of Clinical Microbiology and Infectious Diseases

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GHS Hazard Statement:	H302 (24.76%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P302+P352, P321, P330, P332+P313, P362, and P501
Signal Word:	Warning

Complexity:	84.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	136.088815002
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	136.088815002
Rotatable Bond Count:	2
Topological Polar Surface Area:	20.2 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9