4-Borono-L-phenylalanine - CAS 76410-58-7
Catalog:
BB050309
Product Name:
4-Borono-L-phenylalanine
CAS:
76410-58-7
Synonyms:
(S)-2-amino-3-(4-boronophenyl)propanoic acid; 4-Boronophenylalanine; p-Boronophenylalanine
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BB050309
1 g
$439
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BB050309
2.5 g
$949
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IUPAC Name: (2S)-2-amino-3-(4-boronophenyl)propanoic acid
Description: 4-Borono-L-phenylalanine (CAS# 76410-58-7 ) is a useful research chemical.
Molecular Weight: 209.01
Molecular Formula: C9H12BNO4
Canonical SMILES: B(C1=CC=C(C=C1)CC(C(=O)O)N)(O)O
InChI: InChI=1S/C9H12BNO4/c11-8(9(12)13)5-6-1-3-7(4-2-6)10(14)15/h1-4,8,14-15H,5,11H2,(H,12,13)/t8-/m0/s1
InChI Key: NFIVJOSXJDORSP-QMMMGPOBSA-N
Purity: 98 %
MDL: MFCD01075172
GHS Hazard Statement: H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement: P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word: Warning
Complexity: 216
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 1
Defined Bond Stereocenter Count: 0
Exact Mass: 209.085938
Formal Charge: 0
Heavy Atom Count: 15
Hydrogen Bond Acceptor Count: 5
Hydrogen Bond Donor Count: 4
Isotope Atom Count: 0
Monoisotopic Mass: 209.085938
Rotatable Bond Count: 4
Topological Polar Surface Area: 104
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
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