4-Fluoro-alpha-(hydroxymethyl)benzylamine - CAS 140373-17-7

Catalog:	BB009064
Product Name:	4-Fluoro-alpha-(hydroxymethyl)benzylamine
CAS:	140373-17-7
Synonyms:	2-amino-2-(4-fluorophenyl)ethanol; 2-amino-2-(4-fluorophenyl)ethanol

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Computed Properties

IUPAC Name:	2-amino-2-(4-fluorophenyl)ethanol
Description:	4-Fluoro-alpha-(hydroxymethyl)benzylamine (CAS# 140373-17-7) is a useful research chemical.
Molecular Weight:	155.17
Molecular Formula:	C8H10FNO
Canonical SMILES:	C1=CC(=CC=C1C(CO)N)F
InChI:	InChI=1S/C8H10FNO/c9-7-3-1-6(2-4-7)8(10)5-11/h1-4,8,11H,5,10H2
InChI Key:	SRQPEYLZIUEVIA-UHFFFAOYSA-N
Storage:	Keep in dark place, Inert atmosphere, 2-8 °C
LogP:	1.51810

Publication Number	Title	Priority Date
CN-112852894-A	Amine dehydrogenase mutant and application thereof in synthesis of chiral amine alcohol compound	20200604
WO-2020205501-A1	Complement modulators and related methods	20190329
TW-202102481-A	Complement modulators and related methods	20190329
WO-2019219517-A1	Substituted dihydropyrazolo pyrazine carboxamide derivatives	20180517
AU-2019270142-A1	Substituted dihydropyrazolo pyrazine carboxamide derivatives	20180517

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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	113
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	155.074642105
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	155.074642105
Rotatable Bond Count:	2
Topological Polar Surface Area:	46.2 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2