(S)-(+)-1-amino-1-phenyl-2-methoxyethane - CAS 91298-74-7
Catalog: |
BB040111 |
Product Name: |
(S)-(+)-1-amino-1-phenyl-2-methoxyethane |
CAS: |
91298-74-7 |
Synonyms: |
(1S)-2-methoxy-1-phenylethanamine; (1S)-2-methoxy-1-phenylethanamine |
IUPAC Name: | (1S)-2-methoxy-1-phenylethanamine |
Description: | (S)-(+)-1-amino-1-phenyl-2-methoxyethane (CAS# 91298-74-7) is an intermediate for G700620. |
Molecular Weight: | 151.21 |
Molecular Formula: | C9H13NO |
Canonical SMILES: | COCC(C1=CC=CC=C1)N |
InChI: | InChI=1S/C9H13NO/c1-11-7-9(10)8-5-3-2-4-6-8/h2-6,9H,7,10H2,1H3/t9-/m1/s1 |
InChI Key: | CMTDMIYJXVBUDX-SECBINFHSA-N |
Boiling Point: | 230.2 ℃ at 760 mmHg |
Purity: | 95 % |
Density: | 1.011 g/cm3 |
MDL: | MFCD01862273 |
LogP: | 2.03310 |
GHS Hazard Statement: | H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P273, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112020357-A | Salts of indazolyl-containing tricyclic derivatives and crystal forms thereof | 20190402 |
TW-202012408-A | Substituted dihydropyrazolopyridine carboxamide derivatives | 20180517 |
BR-112020021612-A2 | substituted dihydropyrazole pyrazine carboxamide derivatives | 20180517 |
CN-112469412-A | Substituted dihydropyrazolopyrazine carboxamide derivatives | 20180517 |
EP-3793559-A1 | Substituted dihydropyrazolo pyrazine carboxamide derivatives | 20180517 |
Complexity: | 99.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 151.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 151.099714038 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 35.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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Amines and Anilines
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