2-[2-(Boc-amino)phenyl]acetic Acid - CAS 135807-51-1

Catalog:	BB008249
Product Name:	2-[2-(Boc-amino)phenyl]acetic Acid
CAS:	135807-51-1
Synonyms:	2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]acetic acid; 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]acetic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]acetic acid
Description:	2-[2-(Boc-amino)phenyl]acetic Acid (CAS# 135807-51-1) is a useful research chemical.
Molecular Weight:	251.28
Molecular Formula:	C13H17NO4
Canonical SMILES:	CC(C)(C)OC(=O)NC1=CC=CC=C1CC(=O)O
InChI:	InChI=1S/C13H17NO4/c1-13(2,3)18-12(17)14-10-7-5-4-6-9(10)8-11(15)16/h4-7H,8H2,1-3H3,(H,14,17)(H,15,16)
InChI Key:	FURUSGMMMFSWDW-UHFFFAOYSA-N
MDL:	MFCD09750482
LogP:	2.73370

Publication Number	Title	Priority Date
CN-112500325-A	Alpha, omega-type chain transfer agent for reversible addition-fragmentation chain transfer RAFT polymerization, and preparation method and application thereof	20210207
CN-112961143-A	Ligustrazine derivative and preparation method thereof	20210204
CN-111777520-A	Synthesis method of multi-substituted dimethylamino phenyl acetic acid compound	20200722
JP-2020174673-A	Classification method of solid phase and virus with immobilized sugar chain	20200630
CN-111574917-A	Preparation method of composite material for polyurethane water-based paint	20200609

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Related Functional Groups

Amines and Anilines

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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

Complexity:	309
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	251.11575802
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	251.11575802
Rotatable Bond Count:	5
Topological Polar Surface Area:	75.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9