Octanex Labs | CAS 61477-40-5 | End Use API | Intermediate

CAS 61477-40-5

Chemistry, 9 End Use API, 29 Related Intermediates

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Also known as: 61477-40-5, (3r)-3-aminobutan-1-ol, (r)-3-amino-1-butanol, (3r)-3-amino-1-butanol, (r)-3-amino-butan-1-ol, 1-butanol, 3-amino-, (r)-

Molecular Formula

C₄H₁₁NO

Molecular Weight

89.14 g/mol

InChI Key

AGMZSYQMSHMXLT-SCSAIBSYSA-N

1 2D Structure

CAS 61477-40-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(3R)-3-aminobutan-1-ol

2.1.2 InChI

InChI=1S/C4H11NO/c1-4(5)2-3-6/h4,6H,2-3,5H2,1H3/t4-/m1/s1

2.1.3 InChI Key

AGMZSYQMSHMXLT-SCSAIBSYSA-N

2.1.4 Canonical SMILES

CC(CCO)N

2.1.5 Isomeric SMILES

C[C@H](CCO)N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 61477-40-5

2. (3r)-3-aminobutan-1-ol

3. (r)-3-amino-1-butanol

4. (3r)-3-amino-1-butanol

5. (r)-3-amino-butan-1-ol

6. 1-butanol, 3-amino-, (r)-

7. R-3-amino-1-butanol

8. (r,s)-3-amino-butan-1-ol

9. Dtxsid30432476

10. Bcp01279

11. Zinc2530278

12. Am9719

13. Mfcd13184351

14. Akos015854097

15. Cs-w013746

16. Gs-3850

17. C3441

18. A15693

19. W-204235

2.3 Create Date

2006-10-25

3 Chemical and Physical Properties

Molecular Formula	C₄H₁₁NO
Molecular Weight	89.14 g/mol
XLogP3	-0.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	89.084063974 g/mol
Monoisotopic Mass	89.084063974 g/mol
Topological Polar Surface Area	46.2 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	30.7
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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CAS Number

61477-40-5

Intermediate Name

OctaneX Labs is a leading intermediates and Active Pharmaceutical Ingredients (API) manufacturing company...

OctaneX Labs is a leading intermediates and Active Pharmaceutical Ingredients (API) manufacturing company specializing in the development of innovative processes for the synthesis of a wide range of products. We also undertake custom pharmaceutical services and contract Research Synthesis. We are commited to create better quality of life by being at the forefront of research, manufacturing and marketing of high quality API'S.As a growing organization, we are aware that we can’t achieve our goals singly. We collaborate and work in unison with a large number of reputed and like-minded partners

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