Allylestrenol - 10mM in DMSO , CAS No.432-60-0

CAS: 432-60-0 Cat. No.: A423953 분자식: C21H32O 분자량: 300.48 EC 번호: 207-082-9
주문 가능
GRADE & PURITY 10mM in DMSO
Synonyms
17-Hydroxy-17-alpha-allyl-4-estrene | Alilestrenol [INN-Spanish] | Allilestrenolo | Tox21_111718 | Q531965 | ALLYLESTRENOL [WHO-DD] | AKOS015964938 | WLN: L E5 B666 MUTJ E1 FQ F2U1 | 1,3-di(4-methoxyphenyl)propane-1,3-dione | (17beta)-17-prop-2-en-1-ylest
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
★
Size
USA
독일 (EU)*
Price
Qty
1ml
A423953-1ml
2 재고 있음
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US$47.90

US$69.90
저장 US$22.00 (31.47%)
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🧪

Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

동의어
17-Hydroxy-17-alpha-allyl-4-estrene | Alilestrenol [INN-Spanish] | Allilestrenolo | Tox21_111718 | Q531965 | ALLYLESTRENOL [WHO-DD] | AKOS015964938 | WLN: L E5 B666 MUTJ E1 FQ F2U1 | 1,3-di(4-methoxyphenyl)propane-1,3-dione | (17beta)-17-prop-2-en-1-ylest
사양 및 순도
10mM in DMSO
보관 조건
Store at -80°C
배송
Dry ice packs + Cold packs
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이름과 식별자
Pubchem Sid528773141
정식 스마일CC12CCC3C(C1CCC2(CC=C)O)CCC4=CCCCC34
IUPAC Name(8R,9S,10R,13S,14S,17R)-13-methyl-17-prop-2-enyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol
InChIKeyATXHVCQZZJYMCF-XUDSTZEESA-N
INCHI1S/C21H32O/c1-3-12-21(22)14-11-19-18-9-8-15-6-4-5-7-16(15)17(18)10-13-20(19,21)2/h3,6,16-19,22H,1,4-5,7-14H2,2H3/t16-,17+,18+,19-,20-,21-/m0/s1
이성체 SMILES C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(CC=C)O)CCC4=CCCC[C@H]34
분자량 300.48
Reaxy-Rn 25807395
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=25807395&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassLipids and lipid-like molecules
분류Steroids and steroid derivatives
SubclassEstrane steroids
Intermediate Tree Nodes Not available
Direct ParentEstrane steroids
Alternative Parents 17-hydroxysteroids  Delta-4-steroids  Tertiary alcohols  Cyclic alcohols and derivatives  Hydrocarbon derivatives  
Molecular FrameworkAliphatic homopolycyclic compounds
Substituents 17-hydroxysteroid - Hydroxysteroid - Estrane-skeleton - Delta-4-steroid - Tertiary alcohol - Cyclic alcohol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic homopolycyclic compound
설명This compound belongs to the class of organic compounds known as estrane steroids. These are steroids with a structure based on the estrane skeleton.
External Descriptors C21 steroids (gluco/mineralocorticoids, progestogins) and derivatives
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
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Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
관련 대상(비인간)
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
작용 메커니즘
인증서(CoA, COO, BSE/TSE 및 분석 차트)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
화학 및 물리적 특성
굴절률1.552
특정 회전[α]36° (C=1,CHCl3)
발화점(°C)170.6ºC
끓는점(°C)405.4ºC
녹는점(°C)78 - 81ºC
분자량300.500 g/mol
XLogP35.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass300.245 Da
Monoisotopic Mass300.245 Da
Topological Polar Surface Area20.200 Ų
Heavy Atom Count22
Formal Charge0
Complexity492.000
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
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