4-Amino-2-methyl-2-butanol - CAS 26734-08-7

Catalog:	BB019351
Product Name:	4-Amino-2-methyl-2-butanol
CAS:	26734-08-7
Synonyms:	4-amino-2-methyl-2-butanol; 4-amino-2-methylbutan-2-ol

Technical Data

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Computed Properties

IUPAC Name:	4-amino-2-methylbutan-2-ol
Description:	4-Amino-2-methyl-2-butanol (CAS# 26734-08-7) is a reagent used in pharmaceutical synthesis such as tyrosine kinase 3 (FLT3) inhibitors based on 5-aryl-2-aminopyridines.
Molecular Weight:	103.16
Molecular Formula:	C5H13NO
Canonical SMILES:	CC(C)(CCN)O
InChI:	InChI=1S/C5H13NO/c1-5(2,7)3-4-6/h7H,3-4,6H2,1-2H3
InChI Key:	PUSZHIWAFZLOMD-UHFFFAOYSA-N
Appearance:	Liquid
MDL:	MFCD00129174
LogP:	0.80640

Publication Number	Title	Priority Date
CN-111087408-A	Macrocyclic IDH2 mutant inhibitor and medical application thereof	20200103
CN-111087408-B	Macrocyclic IDH2 mutant inhibitor and medical application thereof	20200103
WO-2021127499-A1	Protein tyrosine phosphatase inhibitors and methods of use thereof	20191218
US-2021130325-A1	Heteroaryl-biphenyl amides for the treatment of pd-l1 diseases	20191016
WO-2021076691-A1	Heteroaryl-biphenyl amides for the treatment of pd-l1 diseases	20191016

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P260, P264, P270, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501
Signal Word:	Danger

Complexity:	52
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	103.099714038
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	103.099714038
Rotatable Bond Count:	2
Topological Polar Surface Area:	46.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.4