3-Amino-1-phenyl-2-butanone Hydrochloride - CAS 191104-46-8
Catalog: |
BB014785 |
Product Name: |
3-Amino-1-phenyl-2-butanone Hydrochloride |
CAS: |
191104-46-8 |
Synonyms: |
3-amino-1-phenyl-2-butanone;hydrochloride; 3-amino-1-phenylbutan-2-one;hydrochloride |
IUPAC Name: | 3-amino-1-phenylbutan-2-one;hydrochloride |
Description: | 3-Amino-1-phenyl-2-butanone Hydrochloride (CAS# 191104-46-8) is a useful research chemical. |
Molecular Weight: | 199.68 |
Molecular Formula: | C10H14ClNO |
Canonical SMILES: | CC(C(=O)CC1=CC=CC=C1)N.Cl |
InChI: | InChI=1S/C10H13NO.ClH/c1-8(11)10(12)7-9-5-3-2-4-6-9;/h2-6,8H,7,11H2,1H3;1H |
InChI Key: | UKQLGHQKJOEJKH-UHFFFAOYSA-N |
LogP: | 0.00000 |
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: | 150 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.0763918 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.0763918 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 43.1 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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